GRRM 23 January 23, 2023 Saddle wB97XD def2svpp 0 1 1 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,33,14,31;35,39,42,45,46/CRV:10.3,11.3;4.3,5.1/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOHC3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s45;s45;/rC:-4.9552,-.6475,1.3781;-5.5406,-.0524,2.1006;-5.4763,-.5875,.4075;-3.9704,-.1599,1.261;-4.7989,-2.0995,1.8265;-4.3116,-2.6764,1.0203;-5.7979,-2.5533,1.9664;-3.981,-2.2851,3.1065;-2.9615,-1.8821,2.9566;-3.8675,-3.363,3.3142;-4.6054,-1.6204,4.3433;-5.6369,-1.9973,4.4731;-4.6482,-.5265,4.2163;-3.8261,-1.9502,5.5835;-1.939,-1.3525,7.1665;-1.3712,-2.1364,6.632;-2.2315,-1.8182,8.1263;-1.0312,-.1504,7.4175;-1.6064,.6524,7.9168;-.7029,.2691,6.4474;.1917,-.4901,8.2648;.7681,-1.2941,7.7679;-.1433,-.9094,9.2331;1.1066,.7068,8.5194;.5256,1.5082,9.0138;1.437,1.1237,7.5495;2.3265,.3627,9.3694;2.9444,-.4125,8.882;2.9653,1.247,9.5354;2.0249,-.0257,10.3585;-3.8836,-3.173,6.0048;-4.0925,-3.0772,7.0914;-3.1664,-.9903,6.3517;-3.2081,.0325,5.9616;-4.4466,2.4303,9.2434;-5.2063,2.2912,10.0328;-4.5853,3.4379,8.8159;-3.4539,2.4044,9.7275;-4.5593,1.3513,8.1688;-5.5487,1.4191,7.6788;-3.812,1.5507,7.3817;-4.3673,-.0549,8.7302;-5.0724,-.2073,9.5709;-3.3616,-.1836,9.1661;-4.6651,-1.2063,7.7884;-4.4719,-2.3949,8.1957;-5.5435,-1.0099,7.1313; -739.263789203838 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.002267793474 0.000470059976 0.032579929425 0.008421691886 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093769656 0.000050490 0.000098243 0.000130933 0.000185264 0.000263666 0.000513503 0.000587857 0.001076649 0.001102411 0.001429360 0.001890808 0.002404047 0.003024553 0.003053590 0.003290588 0.004948079 0.005783193 0.006349836 0.007111455 0.007981868 0.009714790 0.013553278 0.014068525 0.016560514 0.018529468 0.020463998 0.024036794 0.026058388 0.026619085 0.029438125 0.030232899 0.032931573 0.035711850 0.037483115 0.039122648 0.040575307 0.041664395 0.043266600 0.046434491 0.048465629 0.050861634 0.051559052 0.052618677 0.053442702 0.056726570 0.058700953 0.061855079 0.065996454 0.066805445 0.069442361 0.070992466 0.073585619 0.075456061 0.076486654 0.077362154 0.079198479 0.080343635 0.080641131 0.086319657 0.092125216 0.095773576 0.098949730 0.104224588 0.107707859 0.111750172 0.111987917 0.114363010 0.115352789 0.117978377 0.127669009 0.131208645 0.133654498 0.136273698 0.141644152 0.145895962 0.150616453 0.153234092 0.154613835 0.160874247 0.164543839 0.172062666 0.179936912 0.188029862 0.194903097 0.203573638 0.205582028 0.217357156 0.222196071 0.236108579 0.252092803 0.274820837 0.289610571 0.307170815 0.354859003 0.377991392 0.402177274 0.428685661 0.482422449 0.545586813 0.554370286 0.585705096 0.595348210 0.609441780 0.626527754 0.703585315 0.745724038 0.766597608 0.767924885 0.770743448 0.771514381 0.780748784 0.784489909 0.792617306 0.794478237 0.795638296 0.800265950 0.826016594 0.828623150 0.832596142 0.837638483 0.842871938 0.853637599 0.875551267 0.889370142 0.891608756 0.902597879 0.907377883 0.922352044 0.928389043 0.931499395 0.934800000 1.062786178 1.143293668 1.309048016 2 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-4.9608,-.6513,1.375;-5.5452,-.0552,2.0975;-5.482,-.5911,.4045;-3.9754,-.1649,1.2575;-4.8059,-2.1033,1.8241;-4.3193,-2.6809,1.018;-5.8052,-2.5561,1.9644;-3.9875,-2.2886,3.104;-2.9686,-1.8841,2.9537;-3.8721,-3.3664,3.3111;-4.6108,-1.6262,4.3422;-5.6393,-2.0095,4.4768;-4.6612,-.5326,4.2138;-3.823,-1.9526,5.5795;-1.9291,-1.3465,7.1552;-1.3538,-2.1285,6.6252;-2.2287,-1.8147,8.1117;-1.0245,-.1434,7.418;-1.6038,.6563,7.9178;-.6907,.2818,6.452;.1955,-.4844,8.2699;.7737,-1.2877,7.7738;-.1426,-.9051,9.2365;1.1111,.7114,8.5296;.5302,1.5121,9.0252;1.4437,1.1306,7.5614;2.3299,.3644,9.3804;2.9481,-.4099,8.892;2.9691,1.248,9.5491;2.0272,-.026,10.3684;-3.8849,-3.1706,6.0094;-4.1176,-3.0619,7.1058;-3.1503,-.9878,6.3308;-3.1853,.0314,5.929;-4.4355,2.4252,9.2473;-5.1908,2.2911,10.0419;-4.5694,3.4341,8.8217;-3.4396,2.3905,9.7242;-4.5646,1.3487,8.1726;-5.5579,1.4228,7.6913;-3.8225,1.5403,7.3787;-4.377,-.0583,8.7303;-5.0803,-.2118,9.5729;-3.3707,-.1951,9.1625;-4.6778,-1.2007,7.7839;-4.4844,-2.3902,8.1876;-5.5479,-1.0041,7.1169; -739.263916421115 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000891999278 0.000151122046 0.029431399976 0.008421044256 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093702819 0.000049788 0.000101498 0.000131175 0.000193575 0.000263273 0.000515328 0.000588185 0.001087200 0.001106324 0.001429494 0.001885584 0.002414382 0.003038045 0.003068084 0.003305807 0.004948462 0.005788374 0.006399822 0.007039677 0.008085437 0.009752948 0.013550058 0.013989248 0.016582331 0.018533328 0.020453122 0.024000857 0.026060465 0.026619443 0.029441883 0.030238185 0.032930429 0.035716296 0.037484994 0.039123024 0.040575568 0.041665629 0.043265789 0.046432197 0.048456299 0.050856486 0.051559023 0.052618447 0.053440987 0.056726491 0.058701217 0.061855427 0.065995998 0.066806753 0.069441926 0.070992277 0.073586247 0.075455859 0.076486461 0.077362121 0.079197831 0.080343492 0.080641255 0.086318971 0.092123085 0.095771555 0.098949530 0.104224006 0.107707161 0.111750257 0.111987879 0.114364494 0.115352678 0.117976584 0.127668630 0.131208418 0.133654498 0.136273558 0.141643815 0.145894645 0.150615848 0.153232107 0.154614035 0.160873621 0.164543673 0.172062284 0.179936809 0.188029961 0.194902853 0.203571641 0.205582694 0.217354884 0.222194230 0.236109013 0.252084107 0.274824719 0.289611103 0.307167692 0.354838171 0.377973250 0.402138391 0.428657111 0.482419828 0.545585470 0.554369996 0.585704816 0.595348396 0.609441473 0.626526272 0.703585116 0.745723421 0.766597608 0.767924876 0.770743170 0.771514448 0.780748919 0.784489623 0.792617414 0.794478165 0.795638264 0.800266018 0.826016520 0.828622613 0.832596092 0.837638286 0.842871924 0.853637547 0.875551149 0.889370017 0.891608643 0.902597899 0.907377278 0.922351700 0.928389017 0.931499377 0.934798933 1.062772514 1.143292014 1.309057312 3 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-4.9733,-.6591,1.3687;-5.5528,-.0594,2.0922;-5.4994,-.601,.4006;-3.9876,-.1751,1.2446;-4.8191,-2.1099,1.8219;-4.3382,-2.6913,1.015;-5.8187,-2.56,1.9692;-3.9941,-2.2926,3.0979;-2.975,-1.8914,2.9404;-3.8806,-3.3699,3.3084;-4.6086,-1.624,4.3372;-5.638,-2.0029,4.4777;-4.6558,-.5307,4.206;-3.8172,-1.9504,5.5725;-1.9239,-1.3432,7.1482;-1.3453,-2.1222,6.6176;-2.2254,-1.8153,8.1022;-1.0225,-.1391,7.4176;-1.6053,.659,7.916;-.6847,.2884,6.454;.1937,-.4801,8.275;.7756,-1.2814,7.7801;-.1489,-.9037,9.2388;1.1064,.7161,8.5428;.5221,1.5146,9.038;1.4433,1.1387,7.5775;2.3214,.368,9.3987;2.9431,-.404,8.9109;2.9587,1.2519,9.5733;2.0143,-.0258,10.384;-3.8774,-3.1684,6.0012;-4.1127,-3.0604,7.0994;-3.144,-.9856,6.3223;-3.1784,.0329,5.919;-4.4147,2.4223,9.2507;-5.1614,2.2898,10.0538;-4.5485,3.4329,8.8292;-3.4134,2.3814,9.7159;-4.5614,1.349,8.1747;-5.5594,1.4295,7.7043;-3.8267,1.5384,7.3734;-4.3751,-.0601,8.7277;-5.0783,-.2157,9.57;-3.3689,-.1991,9.1593;-4.6758,-1.1997,7.7781;-4.4814,-2.3903,8.1794;-5.5443,-1.0022,7.11; -739.263929477568 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000656569258 0.000095159423 0.026700213879 0.008417936705 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093719888 0.000039112 0.000097316 0.000131066 0.000190653 0.000267855 0.000518619 0.000589033 0.001087598 0.001107128 0.001429452 0.001895271 0.002414037 0.003037987 0.003069026 0.003304472 0.004948076 0.005791529 0.006400305 0.007040672 0.008083939 0.009752602 0.013550289 0.013986838 0.016582253 0.018533340 0.020453660 0.024001460 0.026062393 0.026619615 0.029442318 0.030239370 0.032930656 0.035720312 0.037485248 0.039123088 0.040578232 0.041667459 0.043265806 0.046432179 0.048456060 0.050860893 0.051558983 0.052618652 0.053441286 0.056726436 0.058701186 0.061856741 0.065995659 0.066807877 0.069441957 0.070992232 0.073587910 0.075455928 0.076486494 0.077362245 0.079198055 0.080344009 0.080641291 0.086320477 0.092124164 0.095771735 0.098950111 0.104224185 0.107706915 0.111750258 0.111988032 0.114364909 0.115353137 0.117976571 0.127670165 0.131209145 0.133654562 0.136273577 0.141644276 0.145895938 0.150615757 0.153232419 0.154613997 0.160873603 0.164543503 0.172062227 0.179936908 0.188030531 0.194902790 0.203572194 0.205582937 0.217354853 0.222196689 0.236109043 0.252086876 0.274825967 0.289611121 0.307167387 0.354844189 0.377973534 0.402151813 0.428665047 0.482420142 0.545586087 0.554369945 0.585705031 0.595348620 0.609441801 0.626527597 0.703585742 0.745723996 0.766597605 0.767924851 0.770743729 0.771514410 0.780749357 0.784489790 0.792617435 0.794478502 0.795638335 0.800266147 0.826016902 0.828623662 0.832596101 0.837638372 0.842871929 0.853638788 0.875551269 0.889370588 0.891608798 0.902598323 0.907377716 0.922354582 0.928388959 0.931499530 0.934799470 1.062803872 1.143295195 1.309064296 4 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-4.9867,-.6662,1.3628;-5.5603,-.0622,2.0875;-5.5184,-.6102,.3975;-4.0004,-.1852,1.231;-4.8337,-2.1157,1.8204;-4.359,-2.7014,1.0129;-5.8337,-2.5626,1.975;-4.002,-2.296,3.0924;-2.9823,-1.8993,2.9274;-3.8913,-3.3729,3.3067;-4.607,-1.6201,4.3324;-5.6381,-1.9927,4.4782;-4.6487,-.5269,4.1982;-3.8129,-1.9478,5.5656;-1.918,-1.342,7.1407;-1.3368,-2.1173,6.6073;-2.2194,-1.819,8.0923;-1.02,-.1368,7.4168;-1.6065,.6591,7.914;-.6782,.2932,6.4558;.1925,-.4774,8.2797;.7791,-1.2758,7.7858;-.1545,-.9045,9.2404;1.1005,.7204,8.5563;.5111,1.5162,9.0499;1.4424,1.1464,7.5942;2.311,.3732,9.4189;2.9378,-.3959,8.9331;2.9449,1.2582,9.6;1.9986,-.024,10.4012;-3.8736,-3.1661,5.994;-4.1096,-3.0582,7.0928;-3.138,-.9836,6.3151;-3.1725,.0354,5.9131;-4.3972,2.4191,9.2517;-5.1377,2.2862,10.0602;-4.5324,3.4309,8.8333;-3.3925,2.3755,9.709;-4.5539,1.3485,8.1749;-5.5546,1.4322,7.7115;-3.8243,1.5376,7.369;-4.3673,-.0619,8.7244;-5.0691,-.2189,9.5676;-3.3605,-.2024,9.154;-4.6699,-1.1993,7.7729;-4.476,-2.3905,8.172;-5.5384,-.9999,7.1053; -739.263938577095 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000193253810 0.000036271382 0.027699848540 0.008424150172 0.000300000000 0.000200000000 0.002328544004 0.001552362670 -0.093716708 0.000051692 0.000096264 0.000128154 0.000186644 0.000267561 0.000517759 0.000589514 0.001087467 0.001107142 0.001429512 0.001895743 0.002413958 0.003037978 0.003069015 0.003304277 0.004948345 0.005791497 0.006400515 0.007042102 0.008083780 0.009754827 0.013550436 0.013988105 0.016583643 0.018533283 0.020453719 0.024001790 0.026062559 0.026619640 0.029442706 0.030239621 0.032930615 0.035720702 0.037485398 0.039123306 0.040578739 0.041667765 0.043265806 0.046432333 0.048456285 0.050861215 0.051558987 0.052618547 0.053441380 0.056726422 0.058701180 0.061856260 0.065995564 0.066807975 0.069442021 0.070992174 0.073587939 0.075455905 0.076486341 0.077362065 0.079198107 0.080343976 0.080641391 0.086320553 0.092124735 0.095771878 0.098950076 0.104224741 0.107706685 0.111750314 0.111988078 0.114365170 0.115353492 0.117976906 0.127671103 0.131211124 0.133654551 0.136273598 0.141644452 0.145896423 0.150615888 0.153232372 0.154613962 0.160873620 0.164543316 0.172062241 0.179937331 0.188030499 0.194902780 0.203572207 0.205583095 0.217356587 0.222196031 0.236108427 0.252088192 0.274825989 0.289611287 0.307168427 0.354844166 0.377973439 0.402152841 0.428665100 0.482420062 0.545586343 0.554370045 0.585705136 0.595348712 0.609442230 0.626527590 0.703585997 0.745724047 0.766597622 0.767924815 0.770743876 0.771514635 0.780749596 0.784489916 0.792617600 0.794479096 0.795638463 0.800266155 0.826016897 0.828623711 0.832596331 0.837638620 0.842871976 0.853638827 0.875551298 0.889370771 0.891609034 0.902598307 0.907378023 0.922354773 0.928389027 0.931500147 0.934799513 1.062810645 1.143295210 1.309064128 5 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-4.9988,-.6736,1.3564;-5.5664,-.0653,2.0822;-5.5359,-.6197,.3941;-4.0118,-.1962,1.2173;-4.8476,-2.1218,1.8187;-4.3795,-2.7122,1.0107;-5.8481,-2.565,1.9808;-4.0093,-2.3,3.0866;-2.9889,-1.9082,2.9141;-3.9019,-3.3764,3.3051;-4.6045,-1.6163,4.327;-5.6372,-1.9824,4.4785;-4.6407,-.5233,4.1896;-3.8079,-1.945,5.5585;-1.9133,-1.3401,7.1345;-1.3294,-2.1114,6.5984;-2.2147,-1.822,8.0836;-1.0187,-.1339,7.417;-1.6086,.66,7.9134;-.6735,.2989,6.4585;.1904,-.4741,8.2848;.7812,-1.2701,7.7918;-.1603,-.9044,9.2427;1.0946,.7249,8.5689;.5008,1.5184,9.0609;1.441,1.1536,7.6097;2.3008,.3782,9.4376;2.9318,-.3887,8.9539;2.9319,1.2641,9.6241;1.9837,-.0216,10.4174;-3.8672,-3.1638,5.9852;-4.1047,-3.0573,7.0841;-3.1337,-.9814,6.3094;-3.1685,.0381,5.9083;-4.3774,2.416,9.2539;-5.11,2.2833,10.0698;-4.5142,3.429,8.8392;-3.368,2.3686,9.7008;-4.5479,1.348,8.1763;-5.5527,1.436,7.7222;-3.825,1.5362,7.364;-4.3611,-.064,8.7212;-5.0615,-.2233,9.5651;-3.3536,-.2061,9.1489;-4.665,-1.1985,7.7667;-4.4726,-2.3909,8.1636;-5.5334,-.9968,7.0997; -739.263945322353 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000250262122 0.000051114351 0.026824919256 0.008417741266 0.000300000000 0.000200000000 0.001798114701 0.001198743134 -0.093717832 0.000038818 0.000098918 0.000137807 0.000191549 0.000269587 0.000525336 0.000589572 0.001087746 0.001107772 0.001429706 0.001895772 0.002414177 0.003037973 0.003069025 0.003305181 0.004948505 0.005791474 0.006400499 0.007041887 0.008083710 0.009755166 0.013550432 0.013989085 0.016584871 0.018533187 0.020453776 0.024001817 0.026062500 0.026619639 0.029443016 0.030239687 0.032930582 0.035720941 0.037485394 0.039123408 0.040578778 0.041667793 0.043265805 0.046432383 0.048456709 0.050861400 0.051558822 0.052618389 0.053441264 0.056726309 0.058701114 0.061855859 0.065995768 0.066808015 0.069441841 0.070992125 0.073587938 0.075455866 0.076486135 0.077361895 0.079198134 0.080343984 0.080641519 0.086320793 0.092124708 0.095771988 0.098950052 0.104224739 0.107706540 0.111750294 0.111988098 0.114365097 0.115353809 0.117977215 0.127671466 0.131212181 0.133654531 0.136273591 0.141645042 0.145897034 0.150615845 0.153232348 0.154613894 0.160873654 0.164543053 0.172062232 0.179937387 0.188030610 0.194902859 0.203572793 0.205583759 0.217356281 0.222199646 0.236107476 0.252088761 0.274826158 0.289613840 0.307168555 0.354844420 0.377974580 0.402155270 0.428665621 0.482420005 0.545586459 0.554370039 0.585705413 0.595348878 0.609442752 0.626528407 0.703586245 0.745724426 0.766597636 0.767924740 0.770743908 0.771514604 0.780749615 0.784489915 0.792617629 0.794479805 0.795638338 0.800266150 0.826016932 0.828624102 0.832596311 0.837638563 0.842872014 0.853640024 0.875551314 0.889370913 0.891609078 0.902599943 0.907378029 0.922355855 0.928388955 0.931500790 0.934799438 1.062812918 1.143295525 1.309064273 6 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0138,-.6807,1.351;-5.5736,-.067,2.0785;-5.5579,-.6286,.3924;-4.026,-.2078,1.2024;-4.865,-2.1275,1.8183;-4.4051,-2.7232,1.0094;-5.8661,-2.566,1.9895;-4.0183,-2.3038,3.081;-2.9972,-1.9179,2.8992;-3.9148,-3.3796,3.3038;-4.6014,-1.6113,4.3223;-5.636,-1.9696,4.4807;-4.6309,-.5186,4.1814;-3.8012,-1.9415,5.5513;-1.9066,-1.3383,7.128;-1.3208,-2.1069,6.5901;-2.2084,-1.8238,8.0751;-1.0141,-.1317,7.4159;-1.6069,.6614,7.9101;-.6645,.3023,6.4595;.1908,-.4717,8.2898;.7859,-1.2655,7.7986;-.1648,-.9046,9.2448;1.0908,.7285,8.582;.4921,1.52,9.0714;1.4429,1.1597,7.6259;2.2918,.3826,9.4584;2.9277,-.3821,8.9777;2.9198,1.2694,9.6509;1.9686,-.0196,10.4352;-3.8597,-3.1609,5.9766;-4.0987,-3.0554,7.0757;-3.1265,-.9786,6.3027;-3.1618,.0415,5.9035;-4.3658,2.4126,9.2547;-5.0973,2.279,10.0709;-4.5018,3.4268,8.8423;-3.3564,2.363,9.6999;-4.539,1.3474,8.1755;-5.5438,1.4378,7.7228;-3.8171,1.5363,7.3631;-4.3538,-.066,8.7175;-5.0545,-.2264,9.5608;-3.3467,-.21,9.1452;-4.6585,-1.1983,7.7607;-4.4665,-2.3915,8.155;-5.5266,-.9948,7.0938; -739.263949638491 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000338192348 0.000077420057 0.034481404381 0.008403636321 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093718353 0.000016131 0.000100588 0.000149103 0.000192268 0.000272994 0.000546429 0.000589610 0.001087785 0.001107988 0.001430084 0.001895651 0.002414261 0.003037997 0.003069046 0.003305427 0.004948440 0.005791447 0.006401071 0.007042040 0.008083833 0.009755433 0.013550447 0.013988856 0.016585224 0.018533120 0.020453762 0.024002087 0.026062406 0.026619637 0.029443286 0.030239749 0.032930560 0.035721039 0.037485424 0.039123410 0.040578910 0.041667787 0.043265803 0.046432539 0.048456857 0.050862027 0.051558774 0.052618442 0.053441184 0.056726224 0.058700987 0.061855482 0.065996946 0.066808124 0.069441861 0.070992058 0.073587935 0.075455838 0.076485836 0.077363201 0.079198117 0.080344082 0.080641649 0.086321065 0.092124715 0.095771995 0.098950044 0.104224718 0.107706277 0.111750241 0.111988107 0.114365257 0.115354562 0.117977784 0.127672083 0.131212336 0.133654504 0.136273713 0.141646659 0.145897310 0.150615944 0.153232245 0.154613906 0.160873731 0.164542809 0.172062323 0.179937867 0.188031587 0.194902812 0.203573666 0.205587063 0.217365823 0.222204967 0.236106048 0.252100817 0.274825954 0.289614538 0.307174370 0.354844508 0.377979335 0.402159112 0.428665933 0.482420007 0.545586755 0.554370063 0.585705511 0.595349179 0.609443739 0.626528425 0.703586172 0.745724555 0.766597689 0.767924670 0.770744288 0.771514761 0.780750147 0.784490079 0.792617908 0.794481468 0.795638181 0.800266276 0.826017402 0.828623991 0.832596694 0.837638486 0.842872103 0.853644322 0.875551278 0.889371600 0.891609077 0.902607448 0.907378098 0.922357257 0.928389097 0.931501978 0.934799438 1.062813565 1.143295511 1.309064039 7 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0242,-.6865,1.346;-5.579,-.0696,2.0743;-5.5726,-.6359,.3899;-4.0361,-.2164,1.1915;-4.8765,-2.1323,1.8168;-4.422,-2.7314,1.0076;-5.8778,-2.5677,1.994;-4.0245,-2.3071,3.0759;-3.003,-1.9254,2.888;-3.9235,-3.3824,3.3021;-4.5992,-1.6083,4.3173;-5.635,-1.9608,4.48;-4.6239,-.5158,4.1736;-3.7972,-1.9396,5.5448;-1.9025,-1.3371,7.122;-1.3149,-2.1032,6.5824;-2.2044,-1.8259,8.0673;-1.0124,-.1297,7.4142;-1.6084,.663,7.9051;-.6584,.3045,6.4595;.188,-.4684,8.2945;.7869,-1.2614,7.8065;-.1723,-.902,9.2473;1.0847,.7328,8.5922;.4819,1.5236,9.0777;1.4424,1.1643,7.6385;2.2803,.3885,9.4765;2.9203,-.3756,9.0002;2.906,1.2761,9.6728;1.9514,-.0137,10.4513;-3.8553,-3.1593,5.9689;-4.0952,-3.0549,7.0684;-3.1225,-.9773,6.297;-3.1578,.0431,5.8984;-4.3436,2.4094,9.2568;-5.0628,2.2758,10.0852;-4.4842,3.4246,8.8486;-3.3263,2.3568,9.6861;-4.536,1.3464,8.1773;-5.5474,1.4412,7.7383;-3.824,1.5337,7.3547;-4.3486,-.0684,8.7147;-5.0471,-.2314,9.5595;-3.3404,-.2131,9.1396;-4.6545,-1.1982,7.7554;-4.4632,-2.3924,8.1477;-5.5225,-.9931,7.089; -739.263950897517 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000742704371 0.000150045580 0.027593484935 0.008434795480 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093718330 -0.000095348 0.000105997 0.000168504 0.000205945 0.000283313 0.000589557 0.000675749 0.001089260 0.001108558 0.001431921 0.001896242 0.002414651 0.003037993 0.003069966 0.003306246 0.004949080 0.005791450 0.006401930 0.007042692 0.008084217 0.009755446 0.013550431 0.013988743 0.016586008 0.018533373 0.020453862 0.024002050 0.026062344 0.026619634 0.029443860 0.030239833 0.032930551 0.035721173 0.037485435 0.039123380 0.040579182 0.041667773 0.043265800 0.046432507 0.048456818 0.050864262 0.051558418 0.052618493 0.053441215 0.056726081 0.058700927 0.061855018 0.066002709 0.066808663 0.069442213 0.070991967 0.073587918 0.075455802 0.076485639 0.077371136 0.079198213 0.080344622 0.080642581 0.086321967 0.092125080 0.095772061 0.098950016 0.104224664 0.107706087 0.111750184 0.111988113 0.114366992 0.115356524 0.117979994 0.127672619 0.131212437 0.133654479 0.136274105 0.141652999 0.145897884 0.150616310 0.153232154 0.154614327 0.160873888 0.164542627 0.172062250 0.179938110 0.188038977 0.194902845 0.203581247 0.205599421 0.217386893 0.222271406 0.236107952 0.252123580 0.274826171 0.289634516 0.307186377 0.354845604 0.378011050 0.402173250 0.428666587 0.482419962 0.545586967 0.554371911 0.585705546 0.595349285 0.609448943 0.626528796 0.703586111 0.745724579 0.766597944 0.767924796 0.770746931 0.771514741 0.780751783 0.784490205 0.792621623 0.794481477 0.795638001 0.800266762 0.826019265 0.828623992 0.832596819 0.837638418 0.842873077 0.853671235 0.875551127 0.889372781 0.891609053 0.902648316 0.907378135 0.922365090 0.928389867 0.931501934 0.934800554 1.062813515 1.143295523 1.309063996 8 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0378,-.6931,1.3404;-5.583,-.0694,2.0707;-5.5938,-.6439,.3885;-4.0479,-.2294,1.1755;-4.8947,-2.1376,1.8168;-4.4496,-2.7432,1.0068;-5.8973,-2.5667,2.0036;-4.0344,-2.3113,3.0706;-3.0118,-1.9366,2.8733;-3.9384,-3.3861,3.3012;-4.5961,-1.6031,4.3129;-5.634,-1.9469,4.4829;-4.6135,-.5109,4.1654;-3.7907,-1.9359,5.538;-1.8957,-1.3354,7.1158;-1.3065,-2.0988,6.5741;-2.1978,-1.8279,8.0592;-1.0077,-.1277,7.4132;-1.6061,.664,7.9025;-.6499,.308,6.4606;.1889,-.4662,8.2988;.7917,-1.2573,7.8124;-.1757,-.9021,9.249;1.0818,.7362,8.6035;.4745,1.5254,9.086;1.4449,1.1694,7.6525;2.2722,.3931,9.4952;2.9165,-.3695,9.0224;2.8951,1.2816,9.6966;1.9374,-.0107,10.4675;-3.848,-3.1563,5.9604;-4.0888,-3.0532,7.0602;-3.1157,-.9746,6.2912;-3.1516,.0465,5.8943;-4.3382,2.4057,9.2586;-5.0646,2.2714,10.0782;-4.4722,3.4223,8.8517;-3.3268,2.3499,9.6971;-4.5226,1.3459,8.1767;-5.5291,1.4425,7.7305;-3.805,1.5351,7.3612;-4.3405,-.0705,8.7119;-5.0415,-.2334,9.5545;-3.3338,-.2189,9.1391;-4.6474,-1.1978,7.75;-4.457,-2.3929,8.1397;-5.5152,-.9904,7.0841; -739.263950434272 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001030440738 0.000221727077 0.024913160909 0.008447242776 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093718304 -0.000101537 0.000106838 0.000168281 0.000206088 0.000283598 0.000589607 0.000804413 0.001094919 0.001111978 0.001435278 0.001897320 0.002415686 0.003038366 0.003073173 0.003307333 0.004950692 0.005791829 0.006403468 0.007043591 0.008085977 0.009755640 0.013550400 0.013988670 0.016586392 0.018533962 0.020454456 0.024001996 0.026062389 0.026619632 0.029445218 0.030239970 0.032930684 0.035721187 0.037485454 0.039123490 0.040579624 0.041667873 0.043265833 0.046432498 0.048456856 0.050868611 0.051558294 0.052618731 0.053442876 0.056726307 0.058700920 0.061855093 0.066016147 0.066808958 0.069445217 0.070991813 0.073587850 0.075455834 0.076485418 0.077392041 0.079198241 0.080346425 0.080645232 0.086323587 0.092126942 0.095772186 0.098950035 0.104224853 0.107705841 0.111750119 0.111988249 0.114372122 0.115360640 0.117985538 0.127673528 0.131212440 0.133654427 0.136275222 0.141663435 0.145898141 0.150617916 0.153231986 0.154616544 0.160874349 0.164542558 0.172064117 0.179940050 0.188057355 0.194903180 0.203597149 0.205632345 0.217490163 0.222383435 0.236112329 0.252207838 0.274825886 0.289653490 0.307227073 0.354849277 0.378074856 0.402212652 0.428669600 0.482419875 0.545590073 0.554377064 0.585707480 0.595351182 0.609458788 0.626528887 0.703586052 0.745726258 0.766598479 0.767924688 0.770752994 0.771514892 0.780753639 0.784491147 0.792631748 0.794493555 0.795638127 0.800267828 0.826024030 0.828623776 0.832598082 0.837638477 0.842874989 0.853729545 0.875552227 0.889375580 0.891609012 0.902753512 0.907378217 0.922377726 0.928391883 0.931509384 0.934804185 1.062813583 1.143295504 1.309063814 9 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0525,-.6999,1.3362;-5.5917,-.0723,2.0671;-5.6137,-.6521,.3875;-4.0627,-.2396,1.1643;-4.9108,-2.1429,1.817;-4.4735,-2.7529,1.0064;-5.9133,-2.5678,2.0122;-4.0423,-2.315,3.0654;-3.0194,-1.9469,2.8589;-3.9504,-3.3891,3.3007;-4.5913,-1.5978,4.3079;-5.6309,-1.933,4.4847;-4.6016,-.5061,4.1564;-3.7828,-1.9323,5.5306;-1.8888,-1.3331,7.1103;-1.2976,-2.0941,6.5675;-2.1919,-1.8287,8.0518;-1.003,-.125,7.4131;-1.6045,.666,7.8999;-.6407,.3116,6.4627;.1892,-.4636,8.3046;.7954,-1.2534,7.8205;-.1802,-.9014,9.2521;1.0791,.7391,8.6164;.4682,1.5272,9.096;1.4478,1.1738,7.6682;2.2641,.3958,9.5152;2.912,-.3657,9.0457;2.885,1.2845,9.7215;1.9235,-.0094,10.4848;-3.8392,-3.1533,5.9513;-4.0816,-3.0516,7.0516;-3.108,-.9717,6.2848;-3.144,.0499,5.8894;-4.3248,2.4031,9.2588;-5.0419,2.2671,10.0886;-4.4647,3.4202,8.8552;-3.3064,2.3466,9.6849;-4.5217,1.3452,8.1752;-5.5337,1.444,7.7388;-3.8111,1.5344,7.352;-4.336,-.072,8.7068;-5.0356,-.238,9.5501;-3.3285,-.2193,9.1323;-4.6415,-1.1977,7.7428;-4.4506,-2.3933,8.1309;-5.5087,-.99,7.0763; -739.263951557003 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000731129833 0.000147930698 0.024879743218 0.008221211748 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093718226 -0.000040781 0.000106901 0.000168199 0.000206123 0.000283877 0.000589550 0.000861639 0.001100100 0.001128627 0.001438368 0.001898779 0.002416127 0.003039594 0.003079831 0.003307515 0.004952539 0.005791827 0.006403357 0.007044548 0.008089018 0.009755356 0.013550480 0.013988397 0.016586672 0.018533398 0.020454765 0.024001963 0.026062513 0.026619636 0.029447092 0.030240121 0.032930540 0.035721256 0.037485458 0.039123781 0.040579551 0.041667895 0.043265839 0.046432567 0.048456733 0.050869292 0.051557869 0.052618538 0.053442194 0.056725967 0.058700491 0.061854485 0.066024520 0.066809203 0.069445419 0.070991826 0.073588115 0.075455747 0.076485392 0.077411043 0.079198622 0.080348522 0.080647646 0.086325559 0.092129737 0.095772545 0.098950053 0.104225047 0.107705490 0.111750129 0.111988304 0.114374495 0.115362871 0.117991655 0.127673957 0.131212594 0.133654476 0.136275445 0.141669929 0.145898934 0.150618004 0.153231818 0.154621161 0.160874367 0.164541964 0.172064156 0.179940320 0.188076787 0.194903103 0.203614896 0.205659657 0.217505719 0.222513745 0.236114812 0.252235723 0.274826742 0.289688683 0.307239486 0.354855136 0.378137944 0.402236252 0.428675619 0.482420042 0.545590174 0.554386762 0.585707449 0.595351239 0.609466736 0.626531789 0.703586765 0.745726290 0.766598837 0.767924542 0.770756637 0.771514968 0.780753603 0.784492010 0.792643738 0.794493106 0.795638183 0.800268197 0.826026920 0.828625398 0.832597995 0.837638576 0.842876634 0.853783443 0.875551957 0.889376817 0.891608997 0.902846054 0.907378306 0.922385903 0.928391693 0.931510060 0.934807737 1.062813502 1.143296208 1.309063611 10 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0384,-.6931,1.3412;-5.5848,-.0704,2.071;-5.5936,-.6438,.389;-4.0492,-.2283,1.1775;-4.8941,-2.1375,1.8172;-4.4486,-2.7423,1.0073;-5.8962,-2.5673,2.0036;-4.0337,-2.311,3.0708;-3.0115,-1.9363,2.8735;-3.9374,-3.3858,3.3016;-4.5953,-1.603,4.3128;-5.633,-1.9467,4.4828;-4.6127,-.5109,4.1652;-3.7899,-1.9359,5.5379;-1.8954,-1.3351,7.1162;-1.3061,-2.0987,6.575;-2.1979,-1.8273,8.0597;-1.0074,-.1275,7.4137;-1.6059,.6643,7.9028;-.6495,.3081,6.4611;.1891,-.4663,8.2992;.7916,-1.2575,7.8129;-.1755,-.9022,9.2494;1.0824,.7357,8.604;.4755,1.525,9.0867;1.4453,1.169,7.6531;2.2728,.3919,9.4953;2.9167,-.3708,9.0221;2.8961,1.2801,9.6966;1.9382,-.012,10.4674;-3.8471,-3.1562,5.9603;-4.0882,-3.0532,7.0602;-3.1151,-.9744,6.2911;-3.1508,.0466,5.8942;-4.3373,2.4063,9.2578;-5.0592,2.2715,10.0829;-4.4753,3.4224,8.8513;-3.3221,2.3516,9.6903;-4.5269,1.3459,8.1759;-5.5364,1.4423,7.7342;-3.8126,1.5347,7.3563;-4.3419,-.0701,8.711;-5.0418,-.2339,9.5543;-3.3346,-.2168,9.1371;-4.6477,-1.1979,7.7494;-4.4567,-2.3928,8.1395;-5.5153,-.9913,7.083; -739.263953569579 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000168557882 0.000032235659 0.006934810770 0.001952521120 0.000300000000 0.000200000000 0.002669706070 0.001779804047 -0.093716025 0.000024942 0.000103727 0.000129403 0.000187454 0.000264343 0.000385823 0.000591609 0.001092886 0.001153165 0.001429864 0.001896666 0.002412719 0.003041497 0.003119791 0.003305743 0.004958604 0.005792073 0.006397331 0.007045495 0.008102219 0.009754392 0.013550955 0.013987314 0.016587249 0.018531262 0.020455469 0.024002043 0.026063733 0.026619733 0.029456513 0.030240959 0.032929996 0.035721354 0.037485342 0.039124785 0.040578290 0.041668964 0.043265885 0.046432438 0.048456913 0.050867485 0.051559738 0.052618122 0.053442643 0.056725573 0.058701027 0.061855299 0.066049837 0.066810077 0.069460773 0.070991916 0.073589291 0.075455967 0.076487414 0.077484056 0.079199160 0.080359162 0.080659316 0.086332913 0.092140096 0.095774605 0.098950164 0.104225604 0.107706035 0.111750771 0.111988634 0.114381212 0.115371857 0.118017832 0.127677682 0.131212635 0.133654868 0.136277159 0.141687726 0.145900850 0.150622066 0.153232420 0.154640471 0.160873905 0.164542289 0.172061781 0.179937802 0.188137819 0.194904089 0.203659091 0.205756086 0.217642775 0.222811843 0.236128594 0.252374677 0.274828220 0.289745367 0.307307483 0.354880047 0.378313022 0.402296762 0.428694221 0.482422369 0.545594739 0.554412380 0.585708830 0.595353724 0.609487545 0.626536709 0.703588915 0.745729724 0.766599554 0.767925098 0.770763029 0.771515502 0.780754138 0.784496675 0.792671411 0.794504075 0.795639801 0.800268831 0.826035998 0.828628585 0.832598318 0.837639873 0.842880382 0.853911783 0.875558691 0.889380207 0.891609580 0.903084038 0.907378439 0.922400942 0.928391904 0.931512813 0.934817669 1.062814329 1.143300162 1.309064282 11 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0361,-.6933,1.3403;-5.5789,-.0675,2.0705;-5.5934,-.6438,.3891;-4.0455,-.2321,1.1735;-4.8958,-2.1376,1.818;-4.453,-2.745,1.0083;-5.8991,-2.5641,2.0063;-4.0346,-2.3119,3.071;-3.0115,-1.9397,2.8723;-3.9406,-3.3866,3.3027;-4.5936,-1.6012,4.3129;-5.6321,-1.9425,4.4839;-4.6088,-.5092,4.1643;-3.7884,-1.9346,5.5379;-1.895,-1.3341,7.1176;-1.3057,-2.0978,6.5766;-2.1978,-1.8262,8.061;-1.0069,-.1266,7.4151;-1.6051,.665,7.9051;-.6495,.3095,6.4626;.1901,-.4661,8.2997;.7918,-1.2574,7.8126;-.1739,-.9022,9.2499;1.0843,.7353,8.6041;.4785,1.5246,9.0882;1.4462,1.1691,7.653;2.2757,.3902,9.4935;2.9186,-.3723,9.0188;2.8996,1.2779,9.6949;1.9422,-.0145,10.4657;-3.8454,-3.1552,5.9597;-4.087,-3.0528,7.0596;-3.1144,-.9734,6.292;-3.1502,.0478,5.8956;-4.3416,2.4062,9.2572;-5.0618,2.2701,10.0834;-4.4822,3.422,8.8507;-3.3257,2.3538,9.6882;-4.5308,1.3454,8.176;-5.5409,1.4402,7.7355;-3.8178,1.535,7.3555;-4.3435,-.0704,8.711;-5.0429,-.2354,9.5545;-3.3357,-.2155,9.1368;-4.6478,-1.1983,7.7491;-4.4561,-2.3932,8.139;-5.5151,-.9923,7.0821; -739.263953453543 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000278037283 0.000059332681 0.009472062357 0.002803819422 0.000300000000 0.000200000000 0.001618487976 0.001078991984 -0.093714849 0.000032444 0.000080393 0.000123268 0.000196705 0.000275311 0.000457751 0.000608819 0.001092341 0.001174047 0.001430854 0.001899532 0.002417103 0.003041956 0.003122595 0.003305514 0.004958132 0.005791935 0.006399607 0.007045739 0.008102563 0.009754678 0.013550979 0.013987817 0.016587465 0.018530189 0.020456185 0.024002128 0.026064371 0.026619736 0.029455836 0.030240892 0.032929500 0.035721445 0.037485302 0.039124751 0.040578465 0.041668882 0.043265882 0.046432336 0.048456646 0.050865449 0.051562596 0.052618256 0.053439725 0.056725079 0.058700876 0.061855287 0.066059422 0.066810349 0.069459019 0.070992174 0.073589913 0.075455852 0.076487532 0.077489923 0.079200348 0.080360409 0.080658153 0.086333152 0.092140185 0.095774692 0.098950168 0.104225979 0.107705886 0.111750815 0.111989391 0.114381281 0.115372349 0.118018586 0.127677266 0.131212988 0.133654880 0.136276553 0.141692366 0.145903233 0.150621752 0.153235261 0.154641453 0.160873750 0.164542118 0.172060372 0.179937770 0.188140986 0.194903940 0.203657860 0.205763027 0.217607033 0.222957175 0.236140238 0.252344422 0.274839298 0.289776097 0.307297963 0.354889975 0.378325850 0.402292453 0.428696175 0.482424226 0.545596023 0.554416805 0.585713728 0.595357953 0.609490867 0.626537445 0.703589649 0.745734535 0.766599795 0.767925362 0.770764287 0.771515729 0.780753961 0.784500385 0.792676519 0.794537860 0.795639770 0.800269013 0.826035647 0.828631120 0.832598188 0.837639867 0.842880279 0.853911521 0.875579961 0.889382387 0.891611980 0.903094207 0.907380310 0.922400458 0.928391740 0.931521416 0.934819222 1.062814886 1.143300566 1.309067566 12 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0394,-.6963,1.3378;-5.5802,-.0682,2.067;-5.5969,-.647,.3871;-4.0481,-.2378,1.1698;-4.902,-2.14,1.8182;-4.4624,-2.7501,1.009;-5.9059,-2.5633,2.0092;-4.0387,-2.3142,3.0697;-3.0149,-1.9461,2.8679;-3.9479,-3.3887,3.3039;-4.5924,-1.5987,4.3111;-5.6318,-1.9358,4.4849;-4.6039,-.507,4.1602;-3.7861,-1.9326,5.5354;-1.8928,-1.3329,7.1154;-1.3029,-2.0956,6.5736;-2.1956,-1.8264,8.0581;-1.0053,-.1254,7.4151;-1.6042,.6655,7.9054;-.6471,.3119,6.4634;.191,-.4654,8.3005;.7939,-1.2555,7.813;-.174,-.9031,9.2497;1.0838,.7363,8.608;.4767,1.5245,9.0921;1.4471,1.1716,7.658;2.2741,.3909,9.4989;2.9184,-.3705,9.0243;2.897,1.2789,9.7025;1.9393,-.0153,10.4701;-3.8427,-3.1535,5.9564;-4.0846,-3.0519,7.0564;-3.1121,-.9717,6.29;-3.1481,.0498,5.8944;-4.341,2.4051,9.2591;-5.0631,2.2683,10.0834;-4.4804,3.4215,8.8536;-3.3261,2.3517,9.6923;-4.5281,1.3455,8.1763;-5.5373,1.4408,7.734;-3.8136,1.5362,7.3574;-4.3415,-.0708,8.71;-5.0415,-.2364,9.553;-3.3341,-.2167,9.1364;-4.6455,-1.1979,7.7471;-4.4539,-2.393,8.1361;-5.5129,-.9913,7.0802; -739.263953717310 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000116737374 0.000027535011 0.016435729957 0.004068272850 0.000300000000 0.000200000000 0.003854806592 0.002569871061 -0.093715136 -0.000039802 0.000068308 0.000166818 0.000192748 0.000275394 0.000464668 0.000606759 0.001093861 0.001252388 0.001431772 0.001899516 0.002420132 0.003042992 0.003140664 0.003306035 0.004958414 0.005791817 0.006398395 0.007046001 0.008102296 0.009754434 0.013550770 0.013987369 0.016588068 0.018529124 0.020456014 0.024002150 0.026064037 0.026619730 0.029456602 0.030240912 0.032929192 0.035721472 0.037485247 0.039124798 0.040578245 0.041669111 0.043265901 0.046432154 0.048456509 0.050865604 0.051561574 0.052618460 0.053441195 0.056724481 0.058701974 0.061855210 0.066056504 0.066810351 0.069460044 0.070991738 0.073588856 0.075455837 0.076487786 0.077487995 0.079200057 0.080359586 0.080661226 0.086333439 0.092140762 0.095774426 0.098950112 0.104225984 0.107705937 0.111750791 0.111989219 0.114381078 0.115371843 0.118017877 0.127678123 0.131212866 0.133654820 0.136276607 0.141691467 0.145902457 0.150621442 0.153235032 0.154640330 0.160873640 0.164541927 0.172057701 0.179942536 0.188140265 0.194903865 0.203663450 0.205760872 0.217637825 0.222929768 0.236148605 0.252366771 0.274838111 0.289772690 0.307298867 0.354918358 0.378321845 0.402294317 0.428715536 0.482428278 0.545597878 0.554415664 0.585717490 0.595362529 0.609490655 0.626539404 0.703589471 0.745746866 0.766599772 0.767925497 0.770764592 0.771515833 0.780753782 0.784514470 0.792676315 0.794551817 0.795641239 0.800269089 0.826035721 0.828635324 0.832600719 0.837640204 0.842880318 0.853912362 0.875581157 0.889381925 0.891611473 0.903091648 0.907380476 0.922403374 0.928391575 0.931524339 0.934819129 1.062814989 1.143301336 1.309067365 13 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0381,-.699,1.3327;-5.5676,-.0619,2.0633;-5.6027,-.6497,.3857;-4.0433,-.2504,1.1545;-4.9105,-2.1417,1.8191;-4.4789,-2.7591,1.0108;-5.9173,-2.5563,2.0159;-4.0441,-2.3171,3.0684;-3.0191,-1.9548,2.8625;-3.9581,-3.3913,3.3052;-4.5906,-1.5958,4.3094;-5.6312,-1.9273,4.4865;-4.5975,-.5045,4.156;-3.7835,-1.9307,5.5329;-1.8907,-1.3319,7.114;-1.3,-2.0934,6.5712;-2.1935,-1.827,8.0557;-1.0042,-.1242,7.4156;-1.6041,.6657,7.9062;-.6456,.3143,6.4647;.1916,-.4641,8.3017;.7957,-1.2532,7.814;-.1737,-.903,9.2502;1.0829,.7381,8.611;.4744,1.5254,9.0951;1.4467,1.1744,7.6618;2.2726,.3933,9.5031;2.918,-.3674,9.0288;2.8944,1.2816,9.7077;1.9371,-.0136,10.4737;-3.8399,-3.152,5.9528;-4.0823,-3.0513,7.0529;-3.1099,-.9703,6.2885;-3.1461,.0515,5.8938;-4.3408,2.4028,9.2626;-5.0656,2.2652,10.0845;-4.4785,3.4199,8.8581;-3.3273,2.3484,9.6989;-4.525,1.3448,8.1776;-5.5331,1.4407,7.7326;-3.8082,1.5367,7.3609;-4.3398,-.0723,8.7097;-5.0409,-.2385,9.5517;-3.333,-.2193,9.1371;-4.6436,-1.1981,7.7452;-4.452,-2.3937,8.1329;-5.5107,-.9908,7.0784; -739.263952909813 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000443921530 0.000108699778 0.021259940541 0.005883632247 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093715303 -0.000167578 0.000056648 0.000166984 0.000193023 0.000274751 0.000459171 0.000607212 0.001094454 0.001389213 0.001431509 0.001904953 0.002433451 0.003045224 0.003151398 0.003306285 0.004959969 0.005791806 0.006399916 0.007046149 0.008101476 0.009754313 0.013550466 0.013987167 0.016588170 0.018529566 0.020456000 0.024002224 0.026063870 0.026619733 0.029456265 0.030240918 0.032929972 0.035721585 0.037485259 0.039124822 0.040578320 0.041669179 0.043265895 0.046432549 0.048456951 0.050866884 0.051561557 0.052618423 0.053440894 0.056724001 0.058701765 0.061855751 0.066057564 0.066810336 0.069459953 0.070990900 0.073588004 0.075455830 0.076488899 0.077487482 0.079200209 0.080359172 0.080661859 0.086333688 0.092140128 0.095774216 0.098950377 0.104225838 0.107705799 0.111750809 0.111989301 0.114382456 0.115372013 0.118017553 0.127678256 0.131212723 0.133654892 0.136276750 0.141691610 0.145901813 0.150621390 0.153236356 0.154639969 0.160875982 0.164541872 0.172058342 0.179972084 0.188139575 0.194903794 0.203664942 0.205759069 0.217656923 0.222966779 0.236157224 0.252374296 0.274841326 0.289778845 0.307299904 0.354968105 0.378324248 0.402299358 0.428744294 0.482440732 0.545599260 0.554415209 0.585721528 0.595367635 0.609492386 0.626544016 0.703591864 0.745758191 0.766599818 0.767925942 0.770764575 0.771515924 0.780754491 0.784535306 0.792675604 0.794570104 0.795643607 0.800269355 0.826036943 0.828642348 0.832600614 0.837640126 0.842880642 0.853913266 0.875597394 0.889381925 0.891611449 0.903092548 0.907381897 0.922403414 0.928392792 0.931525777 0.934820031 1.062814874 1.143301348 1.309066919 14 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.036,-.7034,1.3287;-5.5637,-.061,2.0538;-5.5954,-.6517,.3798;-4.0386,-.2629,1.1542;-4.9207,-2.1451,1.8204;-4.497,-2.7695,1.0139;-5.9306,-2.549,2.021;-4.0527,-2.3242,3.0679;-3.0237,-1.976,2.8561;-3.9794,-3.3982,3.3108;-4.5856,-1.5885,4.3067;-5.6299,-1.9066,4.4901;-4.5804,-.4978,4.147;-3.7782,-1.9254,5.5296;-1.8876,-1.3285,7.1141;-1.2961,-2.0887,6.5707;-2.1911,-1.8253,8.0548;-1.0018,-.1209,7.4187;-1.6019,.6672,7.912;-.6441,.3206,6.4688;.1948,-.4627,8.303;.7987,-1.2502,7.8124;-.1696,-.9046,9.2505;1.0862,.7389,8.615;.4782,1.5242,9.1027;1.4484,1.1786,7.6667;2.2774,.3913,9.5039;2.9226,-.367,9.0256;2.899,1.2793,9.7112;1.9435,-.0198,10.4734;-3.8344,-3.1474,5.9472;-4.0779,-3.0491,7.0474;-3.1061,-.9661,6.288;-3.1424,.0566,5.8954;-4.3502,2.4011,9.2656;-5.077,2.2599,10.085;-4.4898,3.4182,8.8621;-3.338,2.3494,9.705;-4.5279,1.3441,8.1787;-5.5348,1.4377,7.7309;-3.8093,1.5393,7.3646;-4.3405,-.0734,8.7091;-5.0422,-.2422,9.5501;-3.3338,-.2191,9.1372;-4.6413,-1.198,7.7424;-4.4489,-2.3941,8.1283;-5.5078,-.9907,7.0747; -739.263949895182 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000883176708 0.000194658990 0.035688406813 0.008378854528 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093715218 -0.000233332 0.000057852 0.000165617 0.000193651 0.000274707 0.000459560 0.000609422 0.001095153 0.001431400 0.001653646 0.001941488 0.002474659 0.003049644 0.003189219 0.003308430 0.004967022 0.005791969 0.006400835 0.007046639 0.008101504 0.009754558 0.013550493 0.013987186 0.016588358 0.018530732 0.020456082 0.024002346 0.026063866 0.026619736 0.029456659 0.030240925 0.032933796 0.035721983 0.037485311 0.039124819 0.040578325 0.041670005 0.043265894 0.046434516 0.048458822 0.050867779 0.051561642 0.052618843 0.053440848 0.056723774 0.058701443 0.061856472 0.066057454 0.066810249 0.069458981 0.070990944 0.073587910 0.075456915 0.076496736 0.077487954 0.079201332 0.080359513 0.080661908 0.086336833 0.092140179 0.095774336 0.098951785 0.104227008 0.107707169 0.111750819 0.111989248 0.114383185 0.115372035 0.118017694 0.127679352 0.131212981 0.133654919 0.136276881 0.141691524 0.145902037 0.150620970 0.153238080 0.154640149 0.160882146 0.164541966 0.172071465 0.180102393 0.188139718 0.194903419 0.203685733 0.205761885 0.217683766 0.223025279 0.236172655 0.252418345 0.274844459 0.289791392 0.307300641 0.355154839 0.378325559 0.402312297 0.428876315 0.482492319 0.545603079 0.554415184 0.585737301 0.595392227 0.609496655 0.626571355 0.703607601 0.745807875 0.766600063 0.767925936 0.770764596 0.771516044 0.780755449 0.784642308 0.792675819 0.794608559 0.795646778 0.800269623 0.826040289 0.828712221 0.832605892 0.837640269 0.842880942 0.853914296 0.875633692 0.889382264 0.891611600 0.903092676 0.907388079 0.922403594 0.928393752 0.931526941 0.934822498 1.062817028 1.143301395 1.309067235 15 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0323,-.7095,1.3186;-5.5336,-.0469,2.0485;-5.6101,-.6596,.3788;-4.0274,-.2901,1.1186;-4.9358,-2.1482,1.8244;-4.5284,-2.7875,1.02;-5.9506,-2.5349,2.0377;-4.0607,-2.3275,3.0673;-3.0309,-1.9886,2.8478;-3.9942,-3.4002,3.3158;-4.5807,-1.5826,4.3048;-5.6259,-1.8918,4.4939;-4.5689,-.4933,4.1404;-3.7713,-1.9202,5.5264;-1.8833,-1.3238,7.1138;-1.2904,-2.0822,6.5693;-2.1874,-1.8231,8.053;-.9988,-.1164,7.4226;-1.5993,.6691,7.9196;-.6421,.3293,6.4742;.1989,-.4612,8.3044;.8033,-1.2455,7.8092;-.1643,-.9085,9.2498;1.0894,.7396,8.6222;.4814,1.5213,9.1159;1.4495,1.1856,7.676;2.2825,.3879,9.5069;2.9278,-.3668,9.0226;2.9035,1.2752,9.7186;1.9509,-.0297,10.4744;-3.8255,-3.1431,5.942;-4.0707,-3.0469,7.0423;-3.1013,-.9611,6.2869;-3.1385,.0622,5.8963;-4.3616,2.399,9.269;-5.0914,2.254,10.0852;-4.5029,3.4166,8.867;-3.3509,2.3496,9.7124;-4.5315,1.3436,8.1791;-5.5371,1.4349,7.7276;-3.8103,1.5428,7.3681;-4.3414,-.0742,8.7076;-5.044,-.246,9.5472;-3.335,-.2182,9.137;-4.6382,-1.198,7.7388;-4.4441,-2.3942,8.1234;-5.5041,-.9915,7.0701; -739.263941352591 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001578565389 0.000358840451 0.030141871387 0.008397708892 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093715085 -0.000316552 0.000061261 0.000165709 0.000193954 0.000278954 0.000469334 0.000610649 0.001095195 0.001431399 0.001793285 0.002056037 0.002563854 0.003051437 0.003271441 0.003330233 0.004977974 0.005792305 0.006401601 0.007047002 0.008102242 0.009755455 0.013550427 0.013987200 0.016588515 0.018533271 0.020456301 0.024002460 0.026063947 0.026619742 0.029456814 0.030240929 0.032945705 0.035722248 0.037485375 0.039124926 0.040578608 0.041671821 0.043265885 0.046436914 0.048461161 0.050868789 0.051561656 0.052619295 0.053440849 0.056723386 0.058702191 0.061856538 0.066057341 0.066810241 0.069457116 0.070990396 0.073587934 0.075458809 0.076509650 0.077488110 0.079202665 0.080359622 0.080663082 0.086340034 0.092140449 0.095774408 0.098953696 0.104228411 0.107708864 0.111750813 0.111989334 0.114383878 0.115372133 0.118017714 0.127680618 0.131213080 0.133654924 0.136276790 0.141691439 0.145901857 0.150620366 0.153242388 0.154640268 0.160891313 0.164543426 0.172084147 0.180288324 0.188140174 0.194903055 0.203710137 0.205768276 0.217783979 0.223134285 0.236183278 0.252538781 0.274850339 0.289827123 0.307299965 0.355436328 0.378326121 0.402332597 0.429074944 0.482563097 0.545612761 0.554415173 0.585757591 0.595432248 0.609501138 0.626606225 0.703628009 0.745873781 0.766600372 0.767926213 0.770764670 0.771516165 0.780756991 0.784786729 0.792676163 0.794679926 0.795646922 0.800269636 0.826042691 0.828787289 0.832608481 0.837643892 0.842880964 0.853914427 0.875731657 0.889382311 0.891612272 0.903092854 0.907395327 0.922403932 0.928393818 0.931536958 0.934823759 1.062817712 1.143301423 1.309068343 16 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0372,-.7193,1.3116;-5.5401,-.0536,2.0325;-5.6066,-.6684,.3689;-4.0323,-.306,1.1186;-4.9511,-2.1555,1.8252;-4.5532,-2.803,1.0236;-5.9681,-2.5311,2.0446;-4.072,-2.3363,3.0647;-3.0376,-2.0147,2.8349;-4.0203,-3.4083,3.3226;-4.5729,-1.5711,4.2996;-5.6233,-1.8616,4.4981;-4.5444,-.4824,4.1263;-3.7628,-1.9115,5.5201;-1.8783,-1.3186,7.1129;-1.2837,-2.0746,6.5668;-2.1836,-1.8216,8.0498;-.9952,-.1116,7.4276;-1.5965,.6707,7.9286;-.6391,.3392,6.4814;.2031,-.4594,8.3073;.8084,-1.2403,7.8079;-.1591,-.9122,9.2505;1.092,.7408,8.6311;.4835,1.5187,9.13;1.4502,1.1928,7.687;2.2868,.3857,9.5121;2.9323,-.3654,9.0228;2.9069,1.2726,9.7278;1.9572,-.0377,10.4776;-3.8167,-3.1356,5.9322;-4.0643,-3.0428,7.0324;-3.0949,-.9543,6.2847;-3.1322,.0703,5.8972;-4.3703,2.3961,9.275;-5.1067,2.2479,10.0845;-4.5091,3.4147,8.8748;-3.3633,2.3464,9.7267;-4.53,1.3438,8.1806;-5.5323,1.4346,7.7218;-3.8031,1.547,7.3756;-4.3411,-.0754,8.7059;-5.0465,-.2497,9.5426;-3.3362,-.2202,9.1383;-4.6345,-1.1968,7.7331;-4.4402,-2.394,8.1146;-5.4991,-.9892,7.063; -739.263935865343 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001469890385 0.000336194554 0.030058381750 0.008599991668 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093714916 -0.000378190 0.000065990 0.000165725 0.000193196 0.000277453 0.000464627 0.000614574 0.001095433 0.001431440 0.001821643 0.002150670 0.002676551 0.003051341 0.003295217 0.003485448 0.004996254 0.005793361 0.006403203 0.007048006 0.008106764 0.009757061 0.013550431 0.013987183 0.016588899 0.018539091 0.020457175 0.024002527 0.026064632 0.026619740 0.029456918 0.030240923 0.032989186 0.035722682 0.037485441 0.039125442 0.040579596 0.041676046 0.043265873 0.046442572 0.048467543 0.050869444 0.051561890 0.052619983 0.053440370 0.056723414 0.058703579 0.061857031 0.066058347 0.066810293 0.069471437 0.070990206 0.073587442 0.075460422 0.076522242 0.077488176 0.079205769 0.080359671 0.080664198 0.086343758 0.092141494 0.095774489 0.098956313 0.104232215 0.107714233 0.111750785 0.111989353 0.114384962 0.115372375 0.118017722 0.127682015 0.131213097 0.133656128 0.136276770 0.141691570 0.145902087 0.150621271 0.153245839 0.154640582 0.160903621 0.164545029 0.172126404 0.180622407 0.188142866 0.194903108 0.203759416 0.205782242 0.217781894 0.223173439 0.236185532 0.252630231 0.274849772 0.289834196 0.307305435 0.355739488 0.378326212 0.402356798 0.429375488 0.482656103 0.545618406 0.554415278 0.585772662 0.595476676 0.609506042 0.626691565 0.703675243 0.745946201 0.766600541 0.767926267 0.770765521 0.771517262 0.780758457 0.784996555 0.792676292 0.794686192 0.795647831 0.800269815 0.826046267 0.828997634 0.832609813 0.837648365 0.842881097 0.853914553 0.875789244 0.889382422 0.891612798 0.903093092 0.907400862 0.922404261 0.928393823 0.931536429 0.934825083 1.062823999 1.143301427 1.309071500 17 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0358,-.7103,1.3204;-5.5481,-.055,2.0456;-5.604,-.6597,.3763;-4.0342,-.284,1.1324;-4.9343,-2.1492,1.8231;-4.5231,-2.7849,1.0188;-5.9475,-2.5398,2.0332;-4.0606,-2.3284,3.0667;-3.0301,-1.9904,2.8472;-3.9952,-3.4014,3.3157;-4.5804,-1.5816,4.304;-5.6266,-1.8892,4.4936;-4.5667,-.4919,4.139;-3.7714,-1.9196,5.5258;-1.8835,-1.324,7.1136;-1.2906,-2.0824,6.569;-2.1877,-1.8235,8.0526;-.9989,-.1167,7.4226;-1.5995,.6688,7.9194;-.642,.329,6.4744;.1986,-.4613,8.3047;.8031,-1.2457,7.8099;-.1648,-.9083,9.2502;1.0888,.7396,8.6223;.4807,1.5214,9.1154;1.4491,1.1851,7.676;2.2817,.3884,9.5074;2.927,-.3666,9.0239;2.9027,1.2758,9.7186;1.95,-.0285,10.4751;-3.8262,-3.1425,5.9412;-4.0715,-3.0465,7.0414;-3.1013,-.961,6.2866;-3.1382,.0625,5.8961;-4.3596,2.3991,9.2694;-5.0906,2.2547,10.0846;-4.4991,3.4168,8.8673;-3.3496,2.3483,9.7141;-4.5294,1.344,8.1793;-5.5344,1.4362,7.7267;-3.8072,1.5428,7.369;-4.3409,-.0741,8.7076;-5.0442,-.2454,9.5467;-3.335,-.2191,9.1375;-4.6383,-1.1976,7.7384;-4.4448,-2.394,8.1227;-5.5041,-.9904,7.0697; -739.263948564454 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000438872590 0.000101653293 0.032381765904 0.008413329357 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093715373 -0.000396954 0.000035084 0.000153990 0.000205394 0.000243464 0.000381865 0.000617817 0.001096809 0.001431796 0.001671147 0.001993392 0.002541464 0.003048856 0.003299293 0.003498567 0.005003399 0.005794780 0.006407223 0.007049163 0.008111906 0.009759069 0.013550553 0.013987192 0.016589698 0.018548842 0.020458253 0.024002530 0.026065231 0.026619726 0.029456981 0.030240915 0.033061225 0.035722995 0.037485525 0.039125923 0.040580423 0.041680430 0.043265886 0.046449748 0.048475403 0.050871297 0.051562255 0.052620264 0.053439934 0.056724671 0.058705806 0.061857193 0.066059079 0.066810329 0.069481903 0.070992287 0.073590120 0.075461332 0.076543618 0.077488026 0.079214653 0.080360390 0.080672403 0.086351548 0.092142420 0.095774600 0.098959063 0.104235600 0.107719841 0.111750761 0.111993684 0.114388319 0.115372469 0.118017731 0.127687431 0.131213527 0.133660481 0.136281187 0.141692146 0.145903346 0.150625982 0.153266601 0.154641149 0.160920605 0.164547565 0.172162912 0.181083524 0.188145481 0.194904776 0.203814502 0.205803111 0.218051456 0.223442986 0.236240767 0.252921947 0.274862937 0.289918782 0.307314136 0.356269307 0.378327964 0.402389215 0.429884750 0.482821461 0.545646433 0.554415409 0.585816710 0.595571476 0.609515021 0.626798581 0.703727758 0.746070794 0.766600767 0.767926721 0.770766966 0.771518720 0.780761363 0.785285042 0.792676298 0.794802997 0.795651897 0.800270154 0.826049850 0.829199164 0.832611289 0.837654310 0.842881606 0.853914558 0.876042171 0.889382508 0.891614428 0.903093721 0.907411118 0.922405370 0.928393886 0.931558516 0.934827288 1.062828413 1.143302170 1.309075121 18 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0556,-.7155,1.3237;-5.5798,-.0704,2.0518;-5.6223,-.6698,.3773;-4.0584,-.2734,1.1398;-4.9335,-2.1553,1.8191;-4.5137,-2.7813,1.0114;-5.9411,-2.5613,2.0279;-4.057,-2.328,3.0618;-3.0283,-1.9854,2.8407;-3.9864,-3.4002,3.3123;-4.5786,-1.5811,4.2983;-5.6251,-1.8884,4.486;-4.5643,-.4914,4.1331;-3.7716,-1.9195,5.5211;-1.8835,-1.326,7.1098;-1.2897,-2.0832,6.5646;-2.1888,-1.8271,8.0477;-1,-.1185,7.4214;-1.6022,.6669,7.9163;-.6406,.3272,6.4741;.195,-.4613,8.3074;.8025,-1.2449,7.8152;-.1709,-.9082,9.2519;1.0816,.7419,8.6269;.4695,1.5234,9.1155;1.4454,1.1864,7.6815;2.2709,.3952,9.5184;2.9201,-.3595,9.0396;2.8889,1.2845,9.7306;1.9352,-.0202,10.4854;-3.8288,-3.1423,5.9368;-4.0757,-3.0455,7.0363;-3.1006,-.9617,6.282;-3.1358,.0616,5.8911;-4.3401,2.3972,9.2742;-5.0783,2.2578,10.0838;-4.4667,3.4174,8.8739;-3.3337,2.3354,9.7261;-4.5121,1.3466,8.18;-5.514,1.4476,7.7223;-3.7842,1.5422,7.3742;-4.3365,-.0742,8.7058;-5.0442,-.2418,9.542;-3.3333,-.2276,9.1395;-4.6383,-1.1944,7.7343;-4.4497,-2.3921,8.1171;-5.503,-.9827,7.0655; -739.263945447557 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000839052911 0.000199867430 0.032175281043 0.008434522242 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093715439 -0.000029703 0.000011597 0.000198030 0.000206673 0.000293610 0.000486531 0.000635934 0.001097973 0.001432148 0.001689254 0.001999550 0.002546343 0.003048895 0.003299861 0.003503055 0.005007685 0.005794771 0.006407112 0.007049219 0.008111694 0.009758865 0.013550585 0.013987105 0.016589668 0.018548574 0.020458260 0.024002667 0.026065146 0.026619736 0.029457009 0.030240913 0.033080697 0.035723912 0.037485634 0.039125921 0.040580537 0.041680640 0.043265894 0.046449657 0.048475884 0.050871422 0.051562451 0.052620215 0.053441972 0.056729914 0.058705301 0.061857060 0.066059766 0.066810590 0.069482649 0.070992744 0.073590307 0.075461415 0.076544191 0.077488016 0.079215363 0.080360392 0.080674695 0.086352978 0.092142468 0.095774836 0.098960208 0.104236039 0.107719952 0.111750817 0.111993993 0.114388558 0.115372787 0.118017876 0.127688833 0.131213794 0.133661287 0.136286408 0.141692671 0.145903719 0.150628497 0.153267359 0.154641250 0.160922148 0.164547176 0.172173488 0.181096080 0.188145493 0.194909342 0.203814439 0.205803216 0.218112126 0.223508611 0.236255095 0.252937738 0.274875269 0.289940220 0.307315661 0.356342675 0.378329401 0.402396985 0.429945620 0.482863590 0.545683073 0.554417057 0.585881383 0.595667380 0.609521148 0.626806670 0.703727665 0.746185336 0.766601484 0.767929252 0.770767062 0.771518708 0.780761356 0.785332289 0.792676461 0.794859641 0.795651971 0.800270237 0.826049852 0.829238547 0.832618605 0.837658502 0.842881828 0.853914590 0.876077259 0.889382879 0.891615038 0.903093854 0.907414889 0.922405306 0.928393797 0.931564236 0.934829453 1.062828370 1.143304446 1.309075683 19 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.056,-.7057,1.3298;-5.5845,-.0687,2.0603;-5.6228,-.658,.3847;-4.063,-.256,1.149;-4.9262,-2.1476,1.8189;-4.5009,-2.7681,1.0093;-5.9323,-2.5603,2.024;-4.0513,-2.3206,3.0626;-3.0261,-1.9637,2.8471;-3.9681,-3.3941,3.3041;-4.5857,-1.5908,4.3039;-5.6281,-1.9137,4.4878;-4.5856,-.5,4.1467;-3.7759,-1.9273,5.5255;-1.8838,-1.3299,7.1082;-1.2911,-2.0888,6.5641;-2.1875,-1.8284,8.0479;-.9998,-.1218,7.4153;-1.6026,.6672,7.9037;-.6368,.318,6.4665;.1918,-.4618,8.3073;.7997,-1.2491,7.8213;-.1784,-.9032,9.2528;1.0797,.741,8.6244;.467,1.5265,9.1062;1.4489,1.1796,7.6782;2.2641,.396,9.5235;2.9138,-.3629,9.0517;2.8835,1.2847,9.7341;1.9229,-.0135,10.4911;-3.8319,-3.1491,5.944;-4.0759,-3.0494,7.0443;-3.1025,-.9677,6.2823;-3.1386,.0547,5.8888;-4.3293,2.4005,9.2615;-5.051,2.2621,10.0858;-4.4677,3.4181,8.859;-3.3144,2.3451,9.6939;-4.5184,1.3443,8.1759;-5.5277,1.4419,7.7345;-3.8042,1.5366,7.357;-4.3333,-.0737,8.7052;-5.0343,-.2414,9.547;-3.3265,-.2217,9.132;-4.6371,-1.1974,7.7384;-4.4461,-2.3938,8.1241;-5.5037,-.9886,7.0715; -739.263951250108 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000496627714 0.000120501509 0.025856874199 0.007616766986 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093715473 0.000058761 0.000079330 0.000154908 0.000204399 0.000291411 0.000454892 0.000645442 0.001096181 0.001432576 0.001688009 0.002002333 0.002540315 0.003048968 0.003298155 0.003497656 0.005037444 0.005794737 0.006409520 0.007049753 0.008113345 0.009760520 0.013550808 0.013987363 0.016590082 0.018550360 0.020459275 0.024003159 0.026065283 0.026619733 0.029458018 0.030240988 0.033104445 0.035725504 0.037485758 0.039126016 0.040579976 0.041680064 0.043265897 0.046449575 0.048474969 0.050872465 0.051564856 0.052618859 0.053442607 0.056736159 0.058706145 0.061856681 0.066060605 0.066810155 0.069459798 0.070991410 0.073589304 0.075461224 0.076543880 0.077490027 0.079215273 0.080360780 0.080674279 0.086354777 0.092144561 0.095776131 0.098961323 0.104235192 0.107719037 0.111750568 0.111992300 0.114388683 0.115373476 0.118017992 0.127688988 0.131213947 0.133661259 0.136288061 0.141693906 0.145903534 0.150626581 0.153265046 0.154641921 0.160926503 0.164547872 0.172176494 0.181087289 0.188149356 0.194915645 0.203816458 0.205806705 0.218049550 0.223548001 0.236260442 0.252928463 0.274881453 0.289945008 0.307305997 0.356345107 0.378340558 0.402404397 0.429948318 0.482878209 0.545702219 0.554420560 0.585925359 0.595719569 0.609525241 0.626806322 0.703729218 0.746220496 0.766601997 0.767931634 0.770767004 0.771518769 0.780762167 0.785330377 0.792676544 0.794851985 0.795652273 0.800270284 0.826049745 0.829221363 0.832616112 0.837660308 0.842881853 0.853918932 0.876066560 0.889384077 0.891615019 0.903094951 0.907419591 0.922409914 0.928394162 0.931560860 0.934831453 1.062826845 1.143306260 1.309076135 20 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0433,-.6987,1.3348;-5.5757,-.0655,2.066;-5.6074,-.6498,.3877;-4.0507,-.2457,1.1581;-4.9095,-2.1416,1.8186;-4.475,-2.7552,1.0094;-5.9142,-2.5608,2.0142;-4.0426,-2.3158,3.0677;-3.0186,-1.9506,2.8621;-3.9538,-3.3901,3.3035;-4.5909,-1.5969,4.3094;-5.6309,-1.9305,4.486;-4.5996,-.5053,4.1572;-3.7833,-1.9316,5.5327;-1.8901,-1.3324,7.1132;-1.2992,-2.0937,6.5705;-2.1931,-1.8276,8.0549;-1.0039,-.1245,7.4153;-1.6042,.6657,7.905;-.6444,.3137,6.4645;.1909,-.4642,8.3027;.7955,-1.2533,7.8156;-.1755,-.9032,9.2507;1.0819,.7381,8.6131;.4729,1.5252,9.0967;1.4467,1.1746,7.6643;2.2705,.3931,9.5063;2.9166,-.3673,9.0323;2.892,1.2815,9.712;1.934,-.0144,10.4763;-3.8397,-3.1527,5.953;-4.082,-3.0516,7.0532;-3.1094,-.971,6.2877;-3.1455,.0507,5.8926;-4.3364,2.4037,9.2594;-5.0577,2.2665,10.0845;-4.4758,3.4204,8.8548;-3.321,2.3497,9.6915;-4.5251,1.3449,8.176;-5.5346,1.441,7.7346;-3.8111,1.5358,7.3567;-4.3389,-.0719,8.7086;-5.0391,-.2381,9.5513;-3.3316,-.2184,9.1351;-4.643,-1.1981,7.7447;-4.4515,-2.3936,8.1329;-5.5102,-.991,7.0779; -739.263953502109 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000191390258 0.000036282131 0.025039037913 0.007452677512 0.000300000000 0.000200000000 0.002351216858 0.001567477905 -0.093715218 0.000030811 0.000105670 0.000178099 0.000196627 0.000308081 0.000495323 0.000650845 0.001097026 0.001432356 0.001511496 0.001952852 0.002499502 0.003049597 0.003291535 0.003384655 0.005038274 0.005794443 0.006421519 0.007049010 0.008113029 0.009763545 0.013552096 0.013987730 0.016591132 0.018552643 0.020459929 0.024003350 0.026065466 0.026619743 0.029459087 0.030241089 0.033084528 0.035725224 0.037485724 0.039126075 0.040579830 0.041679686 0.043265919 0.046449099 0.048474416 0.050873190 0.051566779 0.052618295 0.053443027 0.056738092 0.058707109 0.061859888 0.066059219 0.066812968 0.069462974 0.070990963 0.073590167 0.075461327 0.076545644 0.077492581 0.079216321 0.080362244 0.080672180 0.086356875 0.092145306 0.095776710 0.098961404 0.104235221 0.107719100 0.111751992 0.111989750 0.114388933 0.115373069 0.118018379 0.127688471 0.131213905 0.133662073 0.136284566 0.141694192 0.145903435 0.150630515 0.153269677 0.154641463 0.160932617 0.164548381 0.172187308 0.181056458 0.188150725 0.194916624 0.203815808 0.205805659 0.218038168 0.223552389 0.236271674 0.252918950 0.274880645 0.289943716 0.307308414 0.356326878 0.378345953 0.402405414 0.429887016 0.482864673 0.545699285 0.554421538 0.585928550 0.595721435 0.609525792 0.626791492 0.703723524 0.746213086 0.766602277 0.767937894 0.770765559 0.771518269 0.780761997 0.785306043 0.792675668 0.794857077 0.795664367 0.800271226 0.826049736 0.829206142 0.832615609 0.837661140 0.842880747 0.853919545 0.876042812 0.889383850 0.891613864 0.903094112 0.907419662 0.922410050 0.928393696 0.931562599 0.934832051 1.062825654 1.143305413 1.309075664 21 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0309,-.6923,1.339;-5.5744,-.0658,2.0677;-5.586,-.6423,.3869;-4.0397,-.2323,1.1742;-4.8931,-2.1367,1.8175;-4.45,-2.7453,1.0086;-5.8974,-2.5619,2.0048;-4.0339,-2.3113,3.0719;-3.0111,-1.9373,2.8757;-3.9388,-3.3862,3.3025;-4.5965,-1.6033,4.3137;-5.6343,-1.9474,4.483;-4.6141,-.5112,4.1662;-3.7917,-1.936,5.5392;-1.897,-1.3354,7.1172;-1.3083,-2.0994,6.5761;-2.1991,-1.827,8.0611;-1.0086,-.1278,7.4134;-1.6065,.6639,7.9035;-.6521,.3078,6.4603;.1893,-.4663,8.2972;.7914,-1.2574,7.8099;-.1738,-.9024,9.2479;1.0826,.736,8.6006;.476,1.5252,9.084;1.4442,1.1692,7.6491;2.2744,.3929,9.4905;2.9181,-.3695,9.0166;2.8974,1.2814,9.6911;1.9411,-.0112,10.4631;-3.8491,-3.1564,5.9616;-4.0898,-3.0535,7.0614;-3.117,-.9747,6.2924;-3.1528,.0464,5.8956;-4.3405,2.4056,9.2606;-5.0661,2.2713,10.0823;-4.4757,3.4221,8.8538;-3.3275,2.3501,9.6978;-4.5262,1.3457,8.1779;-5.534,1.4422,7.7327;-3.8091,1.5349,7.3609;-4.343,-.0706,8.7129;-5.0438,-.2338,9.5557;-3.3361,-.2181,9.14;-4.6491,-1.1982,7.7512;-4.4581,-2.3931,8.1411;-5.5168,-.9914,7.0851; -739.263953170922 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000250858540 0.000068730421 0.030526797423 0.008393022069 0.000300000000 0.000200000000 0.001793839669 0.001195893113 -0.093716965 -0.000036832 0.000064833 0.000150754 0.000214559 0.000294719 0.000480369 0.000651763 0.001096165 0.001356660 0.001434627 0.001939783 0.002490342 0.003049898 0.003302682 0.003413555 0.005064468 0.005794863 0.006431269 0.007049190 0.008115464 0.009763634 0.013551860 0.013987252 0.016590988 0.018551410 0.020460311 0.024003344 0.026066436 0.026619729 0.029461366 0.030241234 0.033094434 0.035724998 0.037485636 0.039126282 0.040580010 0.041679758 0.043265996 0.046449449 0.048474274 0.050877238 0.051567896 0.052618391 0.053438960 0.056738777 0.058708533 0.061858999 0.066051930 0.066810879 0.069461757 0.070989909 0.073589219 0.075461740 0.076545479 0.077498563 0.079214499 0.080362752 0.080675720 0.086359009 0.092148087 0.095776635 0.098961671 0.104235131 0.107719048 0.111752147 0.111989783 0.114387351 0.115370218 0.118019732 0.127690083 0.131214261 0.133659599 0.136282655 0.141694842 0.145902339 0.150625438 0.153267003 0.154639748 0.160935560 0.164548893 0.172191806 0.181046195 0.188154368 0.194918325 0.203821765 0.205807132 0.218071110 0.223508928 0.236274650 0.252938453 0.274877469 0.289938361 0.307309388 0.356322490 0.378350186 0.402413476 0.429907786 0.482876909 0.545710170 0.554421334 0.585948420 0.595744590 0.609525711 0.626795061 0.703723776 0.746224541 0.766602379 0.767938592 0.770763907 0.771518432 0.780761834 0.785305720 0.792671904 0.794832359 0.795665783 0.800271017 0.826049658 0.829208559 0.832614562 0.837662268 0.842881181 0.853927094 0.876030494 0.889384223 0.891613394 0.903086807 0.907419227 0.922412196 0.928394207 0.931550195 0.934832648 1.062824834 1.143306643 1.309074596 22 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0121,-.6933,1.3334;-5.5439,-.0546,2.0607;-5.5705,-.6414,.3827;-4.0147,-.2484,1.1617;-4.892,-2.1364,1.8195;-4.4541,-2.7527,1.0147;-5.9006,-2.5493,2.0058;-4.0373,-2.3159,3.0761;-3.0105,-1.9532,2.8806;-3.9535,-3.3908,3.3106;-4.5944,-1.5985,4.3145;-5.6346,-1.9341,4.485;-4.6041,-.507,4.1627;-3.7919,-1.932,5.5412;-1.8995,-1.3321,7.1222;-1.3111,-2.0964,6.5809;-2.2017,-1.8236,8.0662;-1.0103,-.1249,7.4179;-1.6063,.6652,7.9131;-.6583,.3135,6.4644;.1921,-.466,8.2947;.7902,-1.2571,7.803;-.1661,-.9028,9.2469;1.0889,.7346,8.5942;.4872,1.5235,9.0838;1.444,1.1693,7.641;2.2869,.3877,9.4743;2.9257,-.3748,8.9939;2.9129,1.2747,9.6716;1.9607,-.0177,10.4486;-3.8492,-3.1529,5.962;-4.09,-3.052,7.0617;-3.1192,-.9711,6.297;-3.1553,.0505,5.9016;-4.3602,2.4049,9.2669;-5.0882,2.2659,10.0856;-4.4992,3.421,8.8605;-3.3485,2.3543,9.7079;-4.5365,1.3452,8.1824;-5.5429,1.4375,7.7332;-3.8169,1.5384,7.3685;-4.3493,-.0709,8.7166;-5.0499,-.2369,9.5589;-3.3421,-.216,9.1437;-4.6522,-1.1984,7.7536;-4.4596,-2.3933,8.1425;-5.5196,-.9924,7.0867; -739.263950988273 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000544598955 0.000124927952 0.030610514963 0.008423867450 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.093716898 0.000046082 0.000076952 0.000148502 0.000215723 0.000295868 0.000480808 0.000653722 0.001096262 0.001354260 0.001434656 0.001942471 0.002490846 0.003049944 0.003303507 0.003425545 0.005082883 0.005794995 0.006441199 0.007049254 0.008115531 0.009764810 0.013551962 0.013987430 0.016591184 0.018551768 0.020460614 0.024003463 0.026066995 0.026619759 0.029461368 0.030241233 0.033107353 0.035725035 0.037485636 0.039126298 0.040580026 0.041679744 0.043265996 0.046450997 0.048474714 0.050877189 0.051568273 0.052618626 0.053439932 0.056738649 0.058708611 0.061859863 0.066051832 0.066811003 0.069464294 0.070990256 0.073589518 0.075461726 0.076545737 0.077498688 0.079215026 0.080362892 0.080675642 0.086359701 0.092148204 0.095776712 0.098962269 0.104235397 0.107719216 0.111752222 0.111989868 0.114387420 0.115370262 0.118019829 0.127690416 0.131214380 0.133659698 0.136283249 0.141694985 0.145903180 0.150628179 0.153270898 0.154639811 0.160938562 0.164549414 0.172216747 0.181052642 0.188154377 0.194919605 0.203822052 0.205807405 0.218067665 0.223508834 0.236274919 0.252942187 0.274877263 0.289941591 0.307310267 0.356327099 0.378350239 0.402413578 0.429929548 0.482906110 0.545724952 0.554421881 0.585981955 0.595783675 0.609527008 0.626808047 0.703726915 0.746249718 0.766602510 0.767938846 0.770764334 0.771518510 0.780761974 0.785307066 0.792672048 0.794840196 0.795666463 0.800271140 0.826049847 0.829227744 0.832614631 0.837662338 0.842881206 0.853927276 0.876034010 0.889384435 0.891614212 0.903086950 0.907423099 0.922412550 0.928394810 0.931552554 0.934833149 1.062824866 1.143306783 1.309074496 23 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0349,-.6951,1.3376;-5.5745,-.066,2.0671;-5.5931,-.6455,.3872;-4.0431,-.2378,1.1687;-4.8988,-2.1387,1.8183;-4.4586,-2.749,1.0095;-5.903,-2.5616,2.0081;-4.0371,-2.3134,3.0708;-3.0134,-1.9442,2.8709;-3.9456,-3.388,3.3042;-4.5933,-1.5998,4.312;-5.6323,-1.9384,4.4842;-4.6062,-.5081,4.1619;-3.7879,-1.9334,5.5369;-1.8945,-1.3335,7.1168;-1.305,-2.0966,6.5752;-2.1972,-1.8263,8.0598;-1.0067,-.126,7.4153;-1.6051,.665,7.906;-.6496,.311,6.4631;.1906,-.4657,8.2994;.7927,-1.2563,7.8117;-.1732,-.9027,9.2494;1.084,.736,8.6047;.4777,1.5247,9.0892;1.4459,1.1705,7.6539;2.2756,.3911,9.4942;2.919,-.3709,9.0193;2.899,1.279,9.696;1.9421,-.0142,10.4662;-3.8448,-3.1542,5.9582;-4.0865,-3.0523,7.0581;-3.114,-.9724,6.2914;-3.1498,.0489,5.8954;-4.343,2.4052,9.2603;-5.067,2.2688,10.083;-4.4811,3.4215,8.8543;-3.3292,2.3515,9.6957;-4.5282,1.3455,8.1772;-5.5366,1.4408,7.733;-3.8122,1.5361,7.3597;-4.3427,-.0708,8.7113;-5.0432,-.2357,9.554;-3.3356,-.2171,9.1382;-4.6471,-1.198,7.7486;-4.4557,-2.3931,8.1378;-5.5145,-.9913,7.0819; -739.263953801664 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000081157246 0.000017841710 0.010101673093 0.002490495360 0.000300000000 0.000200000000 0.005544791407 0.003696527605 -0.093717194 0.000028002 0.000066754 0.000188106 0.000218002 0.000294287 0.000484121 0.000652183 0.001097180 0.001300214 0.001433661 0.001940584 0.002489844 0.003050186 0.003303657 0.003409356 0.005093011 0.005795185 0.006448498 0.007048535 0.008114723 0.009764317 0.013551363 0.013986900 0.016590910 0.018551137 0.020460113 0.024003432 0.026067291 0.026619767 0.029462313 0.030241276 0.033110341 0.035725051 0.037485597 0.039126236 0.040579730 0.041680368 0.043266016 0.046451696 0.048475236 0.050878137 0.051568130 0.052617813 0.053439916 0.056737412 0.058709168 0.061860075 0.066047623 0.066810642 0.069476112 0.070991080 0.073588912 0.075461819 0.076544341 0.077498949 0.079215124 0.080363302 0.080677571 0.086360600 0.092147858 0.095776666 0.098962433 0.104235570 0.107719064 0.111752135 0.111989713 0.114387118 0.115368557 0.118020192 0.127690828 0.131214524 0.133659321 0.136284183 0.141695027 0.145904027 0.150629897 0.153272034 0.154639255 0.160938526 0.164548558 0.172225409 0.181045474 0.188153770 0.194920132 0.203820422 0.205803179 0.218107611 0.223519126 0.236276540 0.252942591 0.274877773 0.289950498 0.307318012 0.356324130 0.378349475 0.402417156 0.429929435 0.482912957 0.545729484 0.554421929 0.585988462 0.595791984 0.609527061 0.626810509 0.703727096 0.746253293 0.766602469 0.767939813 0.770763415 0.771518571 0.780761875 0.785302024 0.792670726 0.794853832 0.795666880 0.800271265 0.826050060 0.829230778 0.832613026 0.837661703 0.842881248 0.853927768 0.876025628 0.889384277 0.891614209 0.903083768 0.907424023 0.922412815 0.928393364 0.931559229 0.934833742 1.062825281 1.143307094 1.309073700 24 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0373,-.6955,1.337;-5.5729,-.0638,2.0671;-5.5978,-.6451,.388;-4.0444,-.2418,1.1651;-4.9049,-2.1392,1.8188;-4.4687,-2.7519,1.0096;-5.9102,-2.5585,2.0116;-4.0408,-2.3154,3.0695;-3.0163,-1.9497,2.8668;-3.9523,-3.39,3.3038;-4.592,-1.5985,4.3111;-5.6319,-1.9337,4.486;-4.602,-.5068,4.1599;-3.7856,-1.933,5.5351;-1.8922,-1.3336,7.1154;-1.3021,-2.096,6.5734;-2.1949,-1.8272,8.0579;-1.0051,-.1258,7.4151;-1.6044,.6649,7.9051;-.6469,.3114,6.4634;.1912,-.4651,8.3008;.7946,-1.255,7.8135;-.1737,-.9029,9.25;1.0832,.7372,8.6081;.4753,1.5252,9.0918;1.4464,1.1724,7.6581;2.2734,.393,9.4996;2.9184,-.3682,9.0255;2.8956,1.2814,9.7031;1.9384,-.0131,10.4708;-3.8424,-3.154,5.9559;-4.0843,-3.0525,7.0559;-3.1115,-.9724,6.2899;-3.1474,.0492,5.8944;-4.3413,2.4043,9.2593;-5.0651,2.2677,10.0822;-4.4795,3.4207,8.8535;-3.3272,2.3507,9.6945;-4.5266,1.3448,8.1761;-5.5351,1.44,7.7321;-3.8107,1.5356,7.3584;-4.3409,-.0716,8.71;-5.0414,-.2369,9.5525;-3.3338,-.2179,9.1369;-4.6449,-1.1985,7.7468;-4.4534,-2.3938,8.1357;-5.5122,-.9918,7.08; -739.263953774701 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000091170332 0.000021394352 0.007392228044 0.001677451512 0.000300000000 0.000200000000 0.004935816201 0.003290544134 -0.093716845 0.000033231 0.000072622 0.000215091 0.000231519 0.000303618 0.000475135 0.000648769 0.001100617 0.001228878 0.001434504 0.001935812 0.002480776 0.003051205 0.003302527 0.003385965 0.005090844 0.005795144 0.006453700 0.007048249 0.008114388 0.009763939 0.013551253 0.013986300 0.016591225 0.018551071 0.020459937 0.024003448 0.026067512 0.026619793 0.029462380 0.030241307 0.033107768 0.035724934 0.037485576 0.039126380 0.040579669 0.041680449 0.043266040 0.046451502 0.048475445 0.050879204 0.051568348 0.052617605 0.053439066 0.056736230 0.058709385 0.061859572 0.066048208 0.066810276 0.069476086 0.070991532 0.073588001 0.075463000 0.076548962 0.077501016 0.079214783 0.080363315 0.080677489 0.086360380 0.092148097 0.095776720 0.098963278 0.104236340 0.107718980 0.111751932 0.111988272 0.114387464 0.115367584 0.118020340 0.127690904 0.131214603 0.133659266 0.136286869 0.141698201 0.145904698 0.150629742 0.153271376 0.154639202 0.160938258 0.164549780 0.172229392 0.181046419 0.188155959 0.194919368 0.203829412 0.205802796 0.218069022 0.223536651 0.236273892 0.252927156 0.274875355 0.289959801 0.307315334 0.356345026 0.378356423 0.402420781 0.429926690 0.482916187 0.545729581 0.554422457 0.585991523 0.595793233 0.609527387 0.626812245 0.703729030 0.746254995 0.766602413 0.767939587 0.770762833 0.771518604 0.780762032 0.785301097 0.792670336 0.794852605 0.795666719 0.800271337 0.826049899 0.829235069 0.832607934 0.837662230 0.842881101 0.853930393 0.875994469 0.889384195 0.891614582 0.903085782 0.907424201 0.922414278 0.928396110 0.931557905 0.934834474 1.062826339 1.143307715 1.309077778 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.0376,-.6953,1.3379;-5.577,-.0666,2.0678;-5.5963,-.6457,.3878;-4.0461,-.2376,1.1686;-4.9008,-2.139,1.8183;-4.4613,-2.7493,1.009;-5.9049,-2.5621,2.009;-4.0379,-2.3137,3.07;-3.0143,-1.9448,2.869;-3.9466,-3.3883,3.3035;-4.5929,-1.5996,4.3116;-5.632,-1.9376,4.4846;-4.6053,-.5078,4.1613;-3.787,-1.9335,5.5361;-1.8935,-1.3337,7.1159;-1.3037,-2.0965,6.5742;-2.1962,-1.8268,8.0587;-1.006,-.126,7.4149;-1.6048,.6649,7.9051;-.6481,.3109,6.463;.1906,-.4655,8.3002;.7934,-1.2559,7.8129;-.174,-.9027,9.2498;1.0834,.7364,8.6065;.4763,1.5249,9.0902;1.4463,1.171,7.6561;2.274,.3919,9.4973;2.9182,-.37,9.0232;2.8969,1.28,9.7;1.9395,-.0136,10.4689;-3.8439,-3.1543,5.9573;-4.0856,-3.0524,7.0572;-3.1129,-.9726,6.2905;-3.1487,.0489,5.8946;-4.3411,2.405,9.2594;-5.0647,2.2688,10.0825;-4.4792,3.4214,8.8534;-3.327,2.3512,9.6942;-4.5271,1.3453,8.1765;-5.5357,1.4408,7.7328;-3.8114,1.5358,7.3585;-4.3416,-.071,8.7105;-5.0421,-.2359,9.5532;-3.3345,-.2174,9.1373;-4.6461,-1.1981,7.7478;-4.4547,-2.3932,8.1369;-5.5135,-.9914,7.081; -739.263953847628 0 FORWARD BACKWARD 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 -937.00254297 18.13153435 30.25367529 33.83974136 43.33666404 58.18462968 64.02758783 79.08229025 96.56515300 110.14490442 123.36611638 133.70439398 162.56416631 174.53602363 191.24902708 201.69197724 215.84106829 238.73024749 255.99771200 259.32107335 272.67924197 298.23661798 314.87460517 348.95446849 363.50150986 442.35738688 452.17123072 459.36717056 493.26244571 531.36331860 571.52186087 640.44441382 666.50892603 744.73914870 753.24004894 763.20271503 769.00112315 814.52734701 824.44876109 858.41290490 872.94822126 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