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:-4.3778,-3.3251,2.7068;-4.9129,-3.5494,3.6449;-3.8231,-4.234,2.4181;-5.128,-3.1249,1.92;-3.4285,-2.1409,2.8776;-2.8022,-2.0336,1.9738;-2.7295,-2.3513,3.7089;-4.1295,-.8027,3.1302;-4.7381,-.5302,2.2485;-3.3658,-.0116,3.2407;-5.0449,-.7808,4.3673;-5.9082,-1.451,4.2312;-5.4309,.2448,4.5057;-4.3098,-1.1972,5.6111;-2.2572,-.8589,7.0557;-1.8695,-1.7462,6.5233;-2.5522,-1.2328,8.0548;-1.1545,.1916,7.1912;-1.5867,1.1197,7.6089;-.779,.4574,6.1842;.0168,-.2415,8.0741;-.3546,-.4359,9.0991;.7259,.6033,8.1597;.7735,-1.4728,7.5729;1.0755,-1.3087,6.5209;.1003,-2.3488,7.5663;2.0051,-1.7964,8.4147;1.727,-1.9889,9.4663;2.5281,-2.6916,8.0366;2.7244,-.9579,8.4084;-4.5477,-2.3773,6.0894;-4.6571,-2.2218,7.1771;-3.4635,-.3311,6.3026;-3.3656,.6698,5.8653;-4.0254,3.3328,9.1338;-4.7176,3.3298,9.9943;-4.059,4.3367,8.6775;-3.0048,3.1755,9.5261;-4.395,2.2511,8.1218;-5.4069,2.4495,7.7215;-3.7064,2.3128,7.2616;-4.3554,.8495,8.723;-5.0005,.8227,9.6233;-3.3444,.589,9.0813;-4.8893,-.2697,7.8514;-4.846,-1.4603,8.288;-5.7664,.0366,7.2359; -739.264356987717 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.003443059229 0.000475213253 0.023464624203 0.008423147326 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085189138 0.000023824 0.000062861 0.000139107 0.000229587 0.000367388 0.000455056 0.000640603 0.000986613 0.001036231 0.001518504 0.001676688 0.002816148 0.002952605 0.003768371 0.004079293 0.004651314 0.005056898 0.007022369 0.007911075 0.009348524 0.010039899 0.011310037 0.013099156 0.017069728 0.020531764 0.020856931 0.022938988 0.024847480 0.029059625 0.029736377 0.032394133 0.035315713 0.038767548 0.039455783 0.040029111 0.040379785 0.042892121 0.045459157 0.049833163 0.050354077 0.050789761 0.051977567 0.052966940 0.053309803 0.054090719 0.055701776 0.059954565 0.061974640 0.064910729 0.065581412 0.067163728 0.070340878 0.075679985 0.076340950 0.077210818 0.077873887 0.080557791 0.081657152 0.083028060 0.090395651 0.091779397 0.100427495 0.103603727 0.109074967 0.111566434 0.113263652 0.113868621 0.115678380 0.117294043 0.118722290 0.123353236 0.131714496 0.134589071 0.139700416 0.143054430 0.149316793 0.153437789 0.154639492 0.159831168 0.163910015 0.172179784 0.183751699 0.187732502 0.197614519 0.203708362 0.205088617 0.215498605 0.222770956 0.236313976 0.259270602 0.276968373 0.301634721 0.312679043 0.354166894 0.377793146 0.397775432 0.441163731 0.476218810 0.532094084 0.554419129 0.566646734 0.605120597 0.609530467 0.638763253 0.701682856 0.754590190 0.760965129 0.767300548 0.770990942 0.777619139 0.781023694 0.782077218 0.790825304 0.792506523 0.798023319 0.809972877 0.813119250 0.823605910 0.826133361 0.843422717 0.850151647 0.854781360 0.877626177 0.882457085 0.902074826 0.904691049 0.917471108 0.918863795 0.920959673 0.926799110 0.933147320 1.061789614 1.156325451 1.322529221 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:27,1,24,5,21,8,18,15,11,33,14,31;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:-4.3857,-3.3332,2.7135;-4.9137,-3.5514,3.6571;-3.8312,-4.2432,2.4277;-5.1416,-3.1401,1.9303;-3.4372,-2.1461,2.8693;-2.8174,-2.0441,1.9603;-2.7321,-2.3498,3.6972;-4.1381,-.8071,3.1179;-4.7532,-.5414,2.2385;-3.3745,-.0144,3.2172;-5.0448,-.7775,4.3612;-5.9103,-1.4465,4.2332;-5.4281,.2495,4.4974;-4.3038,-1.1934,5.6026;-2.2509,-.8538,7.0479;-1.8576,-1.7386,6.5151;-2.5517,-1.232,8.0437;-1.1496,.1972,7.1959;-1.5849,1.1227,7.6165;-.7682,.4694,6.1927;.0178,-.2396,8.0827;-.3586,-.4404,9.1048;.7254,.6056,8.177;.7792,-1.467,7.5788;1.0848,-1.2977,6.5286;.108,-2.3445,7.5658;2.0086,-1.7922,8.4234;1.7277,-1.9884,9.4736;2.5334,-2.6858,8.044;2.7275,-.9533,8.4219;-4.5406,-2.3725,6.0801;-4.6621,-2.2127,7.1752;-3.4539,-.3268,6.2894;-3.3531,.6725,5.8484;-4.0143,3.3252,9.1422;-4.7014,3.3245,10.0069;-4.0426,4.331,8.6898;-2.9926,3.158,9.5276;-4.3986,2.2504,8.1284;-5.4119,2.4572,7.7358;-3.7154,2.3086,7.2637;-4.3645,.8465,8.7237;-5.012,.8168,9.6224;-3.3554,.5803,9.083;-4.8964,-.2656,7.8444;-4.8538,-1.4583,8.276;-5.7682,.0416,7.2224; -739.264405872815 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000413671179 0.000077102277 0.024707887918 0.008418931428 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085120696 0.000050444 0.000059604 0.000159875 0.000231476 0.000375301 0.000457169 0.000659844 0.000990860 0.001044578 0.001526223 0.001708481 0.002817537 0.002952763 0.003771964 0.004079181 0.004652131 0.005060861 0.007012033 0.007920532 0.009348958 0.010042221 0.011217868 0.013099705 0.017066146 0.020525092 0.020829179 0.022915306 0.024846167 0.029058543 0.029736546 0.032393863 0.035314136 0.038767658 0.039457046 0.040026900 0.040380001 0.042892415 0.045451743 0.049833379 0.050354283 0.050790860 0.051977031 0.052964456 0.053309785 0.054090579 0.055701998 0.059952629 0.061974500 0.064911381 0.065581390 0.067163713 0.070340411 0.075679956 0.076340735 0.077210634 0.077873546 0.080557557 0.081656838 0.083026501 0.090395675 0.091778113 0.100426877 0.103605096 0.109074492 0.111566673 0.113263924 0.113868503 0.115679072 0.117293261 0.118721579 0.123354421 0.131714646 0.134588648 0.139702222 0.143057657 0.149316741 0.153437646 0.154639387 0.159830878 0.163909783 0.172179689 0.183751562 0.187732595 0.197614044 0.203708683 0.205087643 0.215499729 0.222768672 0.236313410 0.259260672 0.276968126 0.301627970 0.312678950 0.354167007 0.377783517 0.397769760 0.441136178 0.476216626 0.532094729 0.554418068 0.566646781 0.605120557 0.609530097 0.638763532 0.701682865 0.754590229 0.760965339 0.767300447 0.770990823 0.777619105 0.781023656 0.782077364 0.790825481 0.792506517 0.798023307 0.809972868 0.813119313 0.823605888 0.826133326 0.843422831 0.850151866 0.854781323 0.877626166 0.882456688 0.902075302 0.904691224 0.917471085 0.918863884 0.920959654 0.926799425 0.933147420 1.061798218 1.156326181 1.322529519 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:27,1,24,5,21,8,18,15,11,33,14,31;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:-4.4026,-3.3378,2.7152;-4.9251,-3.55,3.6632;-3.8535,-4.251,2.4292;-5.1628,-3.1448,1.9362;-3.4484,-2.154,2.8603;-2.8338,-2.0579,1.9471;-2.7391,-2.3574,3.6845;-4.1423,-.8111,3.1081;-4.7603,-.5455,2.2308;-3.3746,-.0215,3.2013;-5.0432,-.773,4.3556;-5.913,-1.4375,4.2327;-5.4199,.2566,4.4906;-4.2993,-1.1907,5.5948;-2.246,-.852,7.0403;-1.8474,-1.7324,6.5041;-2.5497,-1.237,8.0327;-1.1493,.2021,7.1994;-1.5902,1.1243,7.6214;-.7628,.48,6.1997;.0141,-.2346,8.0915;-.368,-.4413,9.1103;.7182,.6126,8.1941;.783,-1.4571,7.5869;1.0954,-1.2816,6.5397;.1146,-2.3366,7.5648;2.0075,-1.7825,8.4385;1.7198,-1.9851,9.4858;2.5381,-2.6722,8.0582;2.7235,-.941,8.4466;-4.5352,-2.3708,6.0712;-4.659,-2.2117,7.1682;-3.4476,-.3252,6.2802;-3.3479,.6752,5.8415;-4.0015,3.3166,9.1461;-4.6818,3.3145,10.0161;-4.0305,4.3242,8.6978;-2.9773,3.1451,9.5231;-4.3963,2.2467,8.1313;-5.4117,2.4578,7.7465;-3.7191,2.3055,7.2619;-4.362,.8409,8.7219;-5.008,.8087,9.6217;-3.3524,.5731,9.0787;-4.895,-.2683,7.8404;-4.8497,-1.4623,8.2676;-5.7657,.0393,7.2178; -739.264416259083 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000351922008 0.000063387857 0.027569615023 0.008431390162 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085160927 0.000041679 0.000065406 0.000152016 0.000236706 0.000370001 0.000457237 0.000647360 0.000986608 0.001044711 0.001526065 0.001707065 0.002817422 0.002953392 0.003771786 0.004079100 0.004652176 0.005060769 0.007011930 0.007920380 0.009349076 0.010043815 0.011227025 0.013099741 0.017066571 0.020528113 0.020835514 0.022922334 0.024846393 0.029059255 0.029736528 0.032394173 0.035315182 0.038767664 0.039456993 0.040027489 0.040381851 0.042892422 0.045456921 0.049833210 0.050354257 0.050790979 0.051977227 0.052964622 0.053309834 0.054090464 0.055701866 0.059952795 0.061974447 0.064911227 0.065581410 0.067163706 0.070340675 0.075679886 0.076340858 0.077210723 0.077873522 0.080557549 0.081656965 0.083026844 0.090395748 0.091778313 0.100427310 0.103605751 0.109074522 0.111566963 0.113263919 0.113868444 0.115679221 0.117293407 0.118721554 0.123359170 0.131714757 0.134588812 0.139702514 0.143058959 0.149316658 0.153437860 0.154639077 0.159830829 0.163909816 0.172179640 0.183751307 0.187732807 0.197613986 0.203708546 0.205087705 0.215499492 0.222767408 0.236311901 0.259261497 0.276968047 0.301628350 0.312678984 0.354167031 0.377783716 0.397770205 0.441137752 0.476216639 0.532094550 0.554418026 0.566646786 0.605120566 0.609530224 0.638763432 0.701682851 0.754590203 0.760965331 0.767300442 0.770990852 0.777619094 0.781023594 0.782077390 0.790825462 0.792506551 0.798023227 0.809972753 0.813119295 0.823605753 0.826133336 0.843422826 0.850151885 0.854781204 0.877626130 0.882456462 0.902075015 0.904690962 0.917470868 0.918863801 0.920959640 0.926799332 0.933147412 1.061798236 1.156325903 1.322528856 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:27,1,24,5,21,8,18,15,11,33,14,31;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:-4.4224,-3.3428,2.7152;-4.9404,-3.549,3.667;-3.8811,-4.2604,2.4283;-5.186,-3.1468,1.9403;-3.4595,-2.165,2.8517;-2.8489,-2.0759,1.9351;-2.7474,-2.3708,3.6729;-4.1428,-.8165,3.0987;-4.7623,-.5488,2.2231;-3.3693,-.0321,3.1869;-5.0393,-.7683,4.3491;-5.914,-1.4273,4.2307;-5.4082,.2643,4.4822;-4.2945,-1.1878,5.5871;-2.2418,-.8493,7.0342;-1.8393,-1.7257,6.4944;-2.546,-1.2401,8.0242;-1.1487,.2075,7.2004;-1.5938,1.1277,7.6219;-.7581,.4882,6.2033;.0114,-.2278,8.0976;-.3753,-.437,9.114;.7128,.621,8.2051;.786,-1.4475,7.5952;1.104,-1.2693,6.5502;.1199,-2.3285,7.5677;2.0065,-1.7716,8.4532;1.7132,-1.9768,9.4983;2.5414,-2.6593,8.0743;2.7203,-.9284,8.4669;-4.5287,-2.3692,6.0605;-4.6544,-2.2125,7.1582;-3.4443,-.3226,6.2751;-3.3455,.6786,5.8381;-3.9907,3.3077,9.1537;-4.6665,3.3028,10.0272;-4.0199,4.3175,8.7103;-2.965,3.1323,9.5246;-4.3929,2.2434,8.136;-5.4094,2.4587,7.7568;-3.7195,2.3043,7.264;-4.3596,.8351,8.7206;-5.0064,.7991,9.6197;-3.3504,.5655,9.0774;-4.8915,-.2706,7.8339;-4.8472,-1.466,8.258;-5.762,.0394,7.212; -739.264423151159 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000121603077 0.000032768586 0.030505584846 0.008438025045 0.000300000000 0.000200000000 0.003700564268 0.002467042845 -0.085163693 0.000045257 0.000065818 0.000141182 0.000237308 0.000372923 0.000458973 0.000649087 0.000991462 0.001044584 0.001525872 0.001706789 0.002817443 0.002953423 0.003772150 0.004079080 0.004652171 0.005061598 0.007012762 0.007920405 0.009349053 0.010043873 0.011226388 0.013099728 0.017066720 0.020527953 0.020835860 0.022922303 0.024846349 0.029059398 0.029736522 0.032394187 0.035315337 0.038767648 0.039456976 0.040027582 0.040382213 0.042892413 0.045457754 0.049833148 0.050354140 0.050790923 0.051977185 0.052964661 0.053309839 0.054090359 0.055701779 0.059952675 0.061974458 0.064910972 0.065581341 0.067163704 0.070340455 0.075679847 0.076340353 0.077210676 0.077873395 0.080557567 0.081656910 0.083026779 0.090395631 0.091778254 0.100427331 0.103605951 0.109074860 0.111566876 0.113263850 0.113868415 0.115679212 0.117293411 0.118721641 0.123359077 0.131714743 0.134588760 0.139702620 0.143059304 0.149316631 0.153437367 0.154638738 0.159830767 0.163909866 0.172179707 0.183751275 0.187732722 0.197613944 0.203708457 0.205087524 0.215499459 0.222766420 0.236310211 0.259261406 0.276967956 0.301628314 0.312678947 0.354167053 0.377783531 0.397770238 0.441137512 0.476216593 0.532094432 0.554417992 0.566646930 0.605120585 0.609530231 0.638763408 0.701682845 0.754590196 0.760965429 0.767300535 0.770990860 0.777619095 0.781023591 0.782077361 0.790825482 0.792506633 0.798023176 0.809972772 0.813119279 0.823605696 0.826133332 0.843422832 0.850151875 0.854781189 0.877626112 0.882456295 0.902075109 0.904690881 0.917470716 0.918863885 0.920960114 0.926799332 0.933147667 1.061798539 1.156326076 1.322528597 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:27,1,24,5,21,8,18,15,11,33,14,31;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:-4.4444,-3.3467,2.7104;-4.9609,-3.548,3.6638;-3.9116,-4.2689,2.4224;-5.2088,-3.1447,1.9379;-3.4715,-2.1768,2.8433;-2.863,-2.0934,1.9249;-2.7588,-2.3881,3.6625;-4.143,-.8225,3.091;-4.7632,-.5509,2.2171;-3.3628,-.0442,3.1757;-5.0351,-.7649,4.3442;-5.9145,-1.4185,4.2301;-5.3966,.2705,4.4753;-4.289,-1.1859,5.581;-2.2373,-.8471,7.0296;-1.8303,-1.7194,6.4864;-2.5427,-1.2438,8.0169;-1.1482,.2128,7.204;-1.5982,1.1304,7.6262;-.7538,.4978,6.2095;.009,-.2214,8.1055;-.3822,-.4351,9.1193;.7071,.6293,8.2191;.7899,-1.4371,7.6032;1.1137,-1.2542,6.5607;.1264,-2.3199,7.5685;2.006,-1.7609,8.4675;1.7069,-1.9712,9.51;2.546,-2.6454,8.0884;2.7172,-.9156,8.489;-4.5215,-2.3686,6.0521;-4.6492,-2.2133,7.1501;-3.4398,-.3208,6.2704;-3.3424,.6815,5.8356;-3.9809,3.3003,9.1583;-4.6512,3.2928,10.0361;-4.0118,4.3117,8.7188;-2.953,3.1225,9.5221;-4.3904,2.2401,8.1393;-5.4087,2.4581,7.7664;-3.7218,2.303,7.2635;-4.3558,.8299,8.719;-5.0015,.7907,9.6187;-3.3462,.5597,9.0738;-4.8879,-.2731,7.8294;-4.8436,-1.4697,8.2503;-5.7582,.0383,7.208; -739.264428043327 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000174234178 0.000038817203 0.034873878447 0.008436157797 0.000300000000 0.000200000000 0.002582730934 0.001721820623 -0.085163834 0.000024402 0.000063218 0.000154052 0.000238913 0.000372993 0.000459337 0.000649047 0.000991547 0.001044600 0.001525916 0.001706676 0.002817441 0.002953425 0.003772092 0.004079056 0.004652177 0.005061577 0.007012962 0.007920366 0.009349038 0.010043884 0.011226368 0.013099730 0.017066717 0.020527896 0.020835878 0.022922292 0.024846337 0.029059407 0.029736508 0.032394210 0.035315372 0.038767644 0.039456956 0.040027523 0.040382247 0.042892398 0.045457866 0.049833049 0.050354058 0.050790810 0.051977075 0.052964276 0.053309773 0.054090275 0.055700994 0.059952623 0.061974507 0.064910417 0.065581295 0.067163714 0.070340216 0.075679756 0.076339846 0.077210613 0.077873402 0.080557582 0.081656808 0.083026860 0.090395557 0.091778226 0.100427328 0.103605976 0.109074906 0.111566781 0.113263744 0.113868358 0.115679212 0.117293470 0.118721591 0.123359076 0.131714793 0.134588722 0.139702516 0.143059254 0.149316504 0.153436726 0.154638269 0.159830659 0.163909925 0.172179515 0.183751233 0.187732677 0.197613887 0.203708339 0.205087299 0.215498664 0.222765458 0.236307616 0.259261438 0.276967681 0.301628105 0.312678681 0.354167147 0.377783357 0.397770273 0.441137382 0.476216539 0.532094153 0.554417923 0.566646930 0.605120586 0.609530228 0.638763276 0.701682753 0.754590172 0.760965302 0.767300520 0.770990841 0.777619093 0.781023585 0.782077342 0.790825461 0.792506571 0.798022984 0.809972593 0.813119201 0.823605498 0.826133301 0.843422785 0.850151828 0.854781147 0.877626030 0.882455589 0.902074889 0.904690613 0.917470289 0.918863823 0.920959863 0.926799070 0.933147638 1.061798534 1.156326045 1.322528267 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:27,1,24,5,21,8,18,15,11,33,14,31;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:-4.4693,-3.3496,2.7055;-4.984,-3.5455,3.6611;-3.9464,-4.2771,2.4158;-5.2347,-3.1406,1.9357;-3.4844,-2.1891,2.8343;-2.8784,-2.1121,1.9135;-2.7708,-2.4069,3.651;-4.1418,-.828,3.0833;-4.7627,-.5515,2.2113;-3.3539,-.0571,3.1643;-5.029,-.7599,4.3396;-5.9139,-1.4069,4.2302;-5.3818,.2788,4.4688;-4.2818,-1.183,5.5749;-2.231,-.8442,7.0255;-1.8209,-1.7135,6.48;-2.5368,-1.2451,8.0109;-1.145,.2178,7.2051;-1.5987,1.1341,7.6262;-.7473,.5045,6.2125;.0093,-.2144,8.1111;-.3853,-.4276,9.1236;.706,.637,8.2266;.7934,-1.4297,7.613;1.1204,-1.2477,6.5716;.131,-2.3131,7.5772;2.0069,-1.7511,8.4817;1.7046,-1.9601,9.5234;2.5489,-2.6358,8.106;2.7171,-.9053,8.5043;-4.5126,-2.3672,6.043;-4.6418,-2.2144,7.1415;-3.4339,-.3184,6.2666;-3.3379,.6851,5.8341;-3.9782,3.2935,9.1644;-4.6468,3.2826,10.0432;-4.0105,4.3063,8.7284;-2.9497,3.1151,9.5257;-4.3889,2.2364,8.1428;-5.4077,2.4551,7.7724;-3.7218,2.3027,7.2663;-4.3525,.8244,8.718;-4.9983,.7815,9.6175;-3.3426,.5544,9.0722;-4.8829,-.2765,7.8247;-4.8376,-1.4742,8.2426;-5.7532,.0357,7.2038; -739.264431595561 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000303377296 0.000057990207 0.031589405061 0.008428079695 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085163974 0.000008220 0.000062586 0.000159925 0.000244202 0.000373823 0.000463343 0.000649113 0.000991603 0.001044693 0.001525912 0.001706692 0.002817440 0.002953435 0.003772283 0.004079031 0.004652254 0.005061572 0.007013008 0.007920309 0.009348963 0.010043811 0.011226360 0.013099705 0.017066711 0.020527901 0.020835872 0.022922281 0.024846330 0.029059404 0.029736510 0.032394204 0.035315339 0.038767640 0.039456923 0.040027471 0.040382238 0.042892388 0.045457890 0.049833006 0.050354007 0.050790701 0.051977119 0.052964043 0.053309704 0.054090109 0.055700598 0.059952616 0.061974637 0.064910220 0.065581409 0.067163718 0.070340099 0.075679749 0.076339829 0.077210757 0.077873582 0.080557579 0.081656695 0.083026911 0.090395572 0.091778220 0.100427329 0.103605984 0.109074936 0.111566734 0.113263605 0.113868345 0.115679238 0.117293584 0.118721765 0.123359086 0.131714757 0.134588697 0.139702624 0.143059249 0.149316436 0.153436321 0.154637824 0.159830670 0.163909869 0.172179272 0.183751165 0.187732743 0.197614108 0.203709527 0.205087533 0.215498928 0.222766730 0.236315192 0.259262554 0.276968228 0.301628308 0.312678507 0.354167567 0.377783352 0.397772034 0.441138276 0.476216530 0.532094265 0.554417889 0.566647182 0.605120606 0.609530274 0.638763252 0.701682621 0.754590180 0.760965426 0.767300513 0.770990831 0.777619240 0.781023666 0.782077356 0.790825464 0.792506592 0.798023527 0.809973089 0.813119245 0.823606101 0.826133300 0.843422783 0.850152085 0.854781373 0.877626533 0.882455322 0.902076638 0.904690621 0.917470119 0.918863684 0.920960805 0.926798958 0.933148032 1.061798609 1.156326152 1.322528099 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:-4.4919,-3.3529,2.7027;-5.0054,-3.543,3.6601;-3.978,-4.2852,2.4128;-5.2575,-3.1381,1.9349;-3.4965,-2.201,2.8273;-2.8925,-2.1304,1.9048;-2.7828,-2.4241,3.6423;-4.1413,-.8339,3.0761;-4.7624,-.5534,2.2056;-3.3465,-.0697,3.1532;-5.0239,-.7553,4.335;-5.9138,-1.3961,4.2302;-5.3684,.2863,4.4619;-4.2758,-1.1805,5.569;-2.2259,-.8421,7.0214;-1.8119,-1.7077,6.4729;-2.5331,-1.2483,8.0043;-1.1434,.2225,7.2088;-1.6013,1.1363,7.6307;-.7421,.5133,6.2187;.0079,-.2095,8.1187;-.3915,-.4294,9.1282;.7007,.6444,8.2423;.7996,-1.4192,7.6186;1.1346,-1.2291,6.5807;.14,-2.3047,7.5714;2.0071,-1.7425,8.4951;1.6966,-1.9609,9.5329;2.5559,-2.6221,8.1167;2.7141,-.8937,8.5305;-4.5052,-2.366,6.0345;-4.6362,-2.2151,7.1338;-3.4287,-.3164,6.2624;-3.3336,.6881,5.8321;-3.9714,3.2872,9.1681;-4.6344,3.2735,10.0514;-4.0066,4.3015,8.7356;-2.9403,3.1076,9.522;-4.3887,2.2334,8.1454;-5.4097,2.4538,7.7813;-3.7264,2.3016,7.2652;-4.3501,.8198,8.7164;-4.9952,.7733,9.6161;-3.3396,.55,9.0691;-4.8793,-.2791,7.8201;-4.8333,-1.4778,8.2351;-5.7494,.0338,7.1992; -739.264433767395 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000522786262 0.000099027526 0.034301348685 0.008400190228 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085163767 -0.000055972 0.000062727 0.000192613 0.000292093 0.000377528 0.000492043 0.000652179 0.000992325 0.001045541 0.001526067 0.001707025 0.002817457 0.002953560 0.003772214 0.004079764 0.004652226 0.005061608 0.007013132 0.007920865 0.009348828 0.010044096 0.011226349 0.013099711 0.017066710 0.020527836 0.020835871 0.022922258 0.024846375 0.029059406 0.029736499 0.032394195 0.035315342 0.038767632 0.039456897 0.040027393 0.040382215 0.042892438 0.045457853 0.049832897 0.050353824 0.050790611 0.051977011 0.052963356 0.053309538 0.054090069 0.055698744 0.059952605 0.061974592 0.064909672 0.065582295 0.067163673 0.070340000 0.075679738 0.076339412 0.077210645 0.077875940 0.080557917 0.081656708 0.083026922 0.090395743 0.091778162 0.100427331 0.103605971 0.109074977 0.111566683 0.113263525 0.113868174 0.115679269 0.117293752 0.118721896 0.123359087 0.131714758 0.134588617 0.139702540 0.143059309 0.149316491 0.153435424 0.154637132 0.159831216 0.163910060 0.172179212 0.183751250 0.187733141 0.197616768 0.203716458 0.205087970 0.215503637 0.222783675 0.236351030 0.259262731 0.276967825 0.301632315 0.312689349 0.354169224 0.377784223 0.397774815 0.441138252 0.476217098 0.532097324 0.554418051 0.566647768 0.605120902 0.609530371 0.638763369 0.701682451 0.754590167 0.760965204 0.767301165 0.770990835 0.777621460 0.781023651 0.782077372 0.790825518 0.792506565 0.798028565 0.809976523 0.813119309 0.823610607 0.826133237 0.843422790 0.850152871 0.854782106 0.877634275 0.882456663 0.902087378 0.904692304 0.917474065 0.918863627 0.920960966 0.926799800 0.933148169 1.061799082 1.156326153 1.322527774 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:-4.5155,-3.3541,2.7001;-5.0259,-3.538,3.6606;-4.0123,-4.2919,2.4084;-5.2831,-3.1326,1.9359;-3.5081,-2.2118,2.8186;-2.9076,-2.1482,1.8931;-2.7928,-2.441,3.6307;-4.1385,-.8381,3.0687;-4.7601,-.5526,2.2001;-3.336,-.0814,3.1421;-5.0162,-.7491,4.3306;-5.9114,-1.3835,4.23;-5.352,.2957,4.4556;-4.2672,-1.1766,5.5632;-2.2192,-.8382,7.0188;-1.8042,-1.7031,6.4702;-2.5263,-1.2454,8.0012;-1.1378,.227,7.2072;-1.597,1.1415,7.6256;-.7341,.5158,6.2177;.0113,-.2024,8.1211;-.3896,-.4155,9.1309;.7053,.6502,8.2405;.8008,-1.4167,7.6297;1.1335,-1.2354,6.5903;.1406,-2.301,7.591;2.0094,-1.7348,8.506;1.7016,-1.942,9.5459;2.5551,-2.6192,8.1356;2.7178,-.8882,8.531;-4.4943,-2.3639,6.025;-4.6275,-2.2159,7.125;-3.422,-.313,6.2595;-3.3288,.6931,5.8325;-3.9763,3.281,9.1757;-4.6429,3.2639,10.0558;-4.011,4.2963,8.7458;-2.947,3.102,9.5335;-4.3877,2.2293,8.149;-5.4073,2.4489,7.7816;-3.7224,2.3013,7.2719;-4.3489,.8142,8.7163;-4.9962,.7645,9.6144;-3.339,.5446,9.0707;-4.8749,-.283,7.8159;-4.827,-1.4829,8.2274;-5.7448,.03,7.1949; -739.264434249542 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001032962138 0.000170463167 0.033581671955 0.008420188756 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085163610 -0.000063859 0.000062657 0.000192743 0.000325748 0.000389613 0.000548908 0.000665570 0.000995681 0.001049183 0.001528473 0.001706980 0.002817499 0.002953756 0.003772323 0.004084564 0.004652102 0.005061626 0.007014510 0.007921415 0.009348711 0.010044017 0.011226350 0.013099748 0.017066673 0.020527818 0.020836000 0.022922279 0.024846536 0.029059488 0.029736517 0.032394192 0.035315481 0.038767638 0.039456824 0.040027407 0.040382301 0.042892396 0.045457820 0.049832930 0.050353970 0.050790583 0.051977201 0.052962970 0.053309406 0.054090065 0.055700206 0.059952615 0.061974518 0.064913725 0.065584070 0.067163815 0.070339862 0.075681130 0.076344707 0.077211238 0.077882298 0.080558763 0.081657002 0.083026919 0.090396241 0.091778245 0.100427333 0.103605907 0.109075026 0.111566957 0.113263372 0.113868906 0.115679628 0.117294537 0.118722536 0.123359340 0.131714859 0.134588632 0.139703255 0.143059685 0.149318072 0.153436984 0.154637387 0.159834628 0.163909976 0.172179080 0.183751288 0.187733914 0.197623059 0.203744676 0.205099688 0.215501363 0.222816157 0.236508415 0.259268900 0.276975798 0.301644516 0.312702208 0.354181447 0.377788509 0.397786012 0.441138386 0.476220442 0.532103321 0.554418273 0.566651750 0.605121331 0.609530679 0.638763515 0.701682299 0.754590428 0.760966925 0.767301994 0.770991193 0.777627371 0.781024416 0.782077436 0.790825680 0.792506613 0.798045425 0.809986837 0.813120374 0.823622491 0.826133283 0.843422792 0.850155929 0.854785136 0.877658344 0.882456488 0.902124584 0.904700032 0.917476624 0.918863571 0.920971292 0.926800030 0.933150720 1.061799184 1.156326443 1.322531101 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:-4.5395,-3.3559,2.6981;-5.0471,-3.5341,3.6608;-4.0459,-4.2983,2.4055;-5.3081,-3.1284,1.9368;-3.5216,-2.2227,2.8111;-2.9246,-2.1653,1.8832;-2.8053,-2.4576,3.6205;-4.1388,-.8434,3.062;-4.7611,-.5535,2.1953;-3.3296,-.0937,3.1315;-5.0111,-.745,4.3268;-5.9106,-1.3738,4.2308;-5.3393,.3021,4.4499;-4.2603,-1.1742,5.5577;-2.2123,-.8363,7.0136;-1.794,-1.6977,6.4617;-2.5201,-1.2486,7.9938;-1.1339,.2312,7.2089;-1.5971,1.1436,7.6281;-.7264,.5236,6.2218;.0119,-.1979,8.1271;-.3941,-.4161,9.1343;.7032,.6568,8.2536;.8079,-1.4081,7.635;1.1504,-1.22,6.599;.1489,-2.2941,7.5848;2.0092,-1.7286,8.5213;1.6909,-1.9448,9.5574;2.5612,-2.6088,8.149;2.7155,-.8793,8.56;-4.4857,-2.3627,6.0173;-4.6192,-2.217,7.118;-3.4155,-.311,6.2552;-3.3235,.6961,5.8302;-3.9769,3.2766,9.1799;-4.6416,3.255,10.0616;-4.0155,4.2931,8.753;-2.9459,3.0993,9.5349;-4.3875,2.2268,8.1505;-5.4087,2.4448,7.7858;-3.7239,2.3027,7.272;-4.3439,.8103,8.714;-4.9894,.7567,9.6131;-3.3326,.5425,9.066;-4.8684,-.2857,7.8117;-4.8187,-1.4863,8.2212;-5.7389,.0271,7.1916; -739.264436175769 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000760217171 0.000130491057 0.036721406274 0.008456038083 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085163525 -0.000061978 0.000063747 0.000195208 0.000329917 0.000403218 0.000568398 0.000699709 0.000999475 0.001056593 0.001532328 0.001707524 0.002817519 0.002953915 0.003772349 0.004090360 0.004652299 0.005062478 0.007017236 0.007921895 0.009348563 0.010044052 0.011226403 0.013099837 0.017066668 0.020527797 0.020836244 0.022922328 0.024846629 0.029059493 0.029736553 0.032394181 0.035315834 0.038767629 0.039456761 0.040027410 0.040382392 0.042892560 0.045457799 0.049832789 0.050353682 0.050790784 0.051976882 0.052962212 0.053309279 0.054090477 0.055697292 0.059952556 0.061974458 0.064916838 0.065584305 0.067163901 0.070339627 0.075683823 0.076345695 0.077211092 0.077890839 0.080559648 0.081656966 0.083026837 0.090396414 0.091778619 0.100427389 0.103605874 0.109075125 0.111567044 0.113263239 0.113868599 0.115679694 0.117294745 0.118722921 0.123359637 0.131714808 0.134588496 0.139703112 0.143059562 0.149318968 0.153435908 0.154636909 0.159837354 0.163910649 0.172178821 0.183751205 0.187734008 0.197627185 0.203766129 0.205109677 0.215523999 0.222840503 0.236642890 0.259268474 0.276977729 0.301651824 0.312738288 0.354187289 0.377788413 0.397792348 0.441138692 0.476224629 0.532114725 0.554418271 0.566654570 0.605121326 0.609530792 0.638763515 0.701682831 0.754591479 0.760966973 0.767303301 0.770991318 0.777632673 0.781024516 0.782077427 0.790825657 0.792506580 0.798057700 0.809993821 0.813120938 0.823627881 0.826133451 0.843422901 0.850156090 0.854785114 0.877694747 0.882457765 0.902146648 0.904708266 0.917487735 0.918865401 0.920974260 0.926800569 0.933150790 1.061799781 1.156326468 1.322532842 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:-4.5642,-3.3579,2.6967;-5.0682,-3.5289,3.6628;-4.0826,-4.3063,2.4025;-5.3348,-3.1231,1.9395;-3.5333,-2.2355,2.8025;-2.9403,-2.1862,1.8713;-2.8154,-2.4769,3.6086;-4.1343,-.8488,3.0538;-4.7567,-.5535,2.1891;-3.3165,-.1078,3.119;-5.0014,-.7379,4.3216;-5.9073,-1.3586,4.2304;-5.3191,.313,4.4419;-4.2508,-1.1701,5.5514;-2.2063,-.8326,7.0131;-1.7855,-1.6923,6.4607;-2.5156,-1.2471,7.9917;-1.1301,.2362,7.2126;-1.5955,1.1478,7.6308;-.7203,.5298,6.227;.0138,-.192,8.1335;-.3937,-.4087,9.1401;.7046,.6626,8.2599;.8101,-1.4029,7.6446;1.1503,-1.2179,6.6082;.1524,-2.289,7.5987;2.0129,-1.7201,8.5292;1.6978,-1.9309,9.5663;2.5635,-2.6022,8.1603;2.7189,-.8715,8.5616;-4.4746,-2.3605,6.0069;-4.612,-2.2174,7.1085;-3.4085,-.3077,6.2527;-3.3175,.7009,5.8312;-3.9775,3.2699,9.1856;-4.6413,3.2459,10.068;-4.0167,4.2876,8.7616;-2.946,3.0918,9.5391;-4.3891,2.2228,8.1537;-5.4106,2.4419,7.7901;-3.726,2.3009,7.2751;-4.3453,.8047,8.7132;-4.9932,.7475,9.6104;-3.3348,.5372,9.0672;-4.866,-.2894,7.8061;-4.8154,-1.4913,8.2119;-5.7354,.0238,7.1845; -739.264436809601 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000704839432 0.000123303325 0.033881351924 0.008463783094 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085163337 -0.000064002 0.000064330 0.000211526 0.000334236 0.000428725 0.000567465 0.000742658 0.001001412 0.001061090 0.001534525 0.001707384 0.002817630 0.002953907 0.003772316 0.004093044 0.004652270 0.005062787 0.007019807 0.007921808 0.009348433 0.010044005 0.011226487 0.013099938 0.017066787 0.020528073 0.020836180 0.022922354 0.024846769 0.029059491 0.029736586 0.032394355 0.035315802 0.038767668 0.039456664 0.040027357 0.040382452 0.042892752 0.045457769 0.049832840 0.050353760 0.050791945 0.051976563 0.052961540 0.053309903 0.054090167 0.055699353 0.059952643 0.061974218 0.064919918 0.065584631 0.067165017 0.070339394 0.075687516 0.076352505 0.077211206 0.077894174 0.080559934 0.081656666 0.083026847 0.090396377 0.091779853 0.100427414 0.103605914 0.109075254 0.111567036 0.113264078 0.113868787 0.115679767 0.117294745 0.118722918 0.123360596 0.131714982 0.134588408 0.139703042 0.143060387 0.149319432 0.153439841 0.154640831 0.159838643 0.163910410 0.172179796 0.183752808 0.187734260 0.197630931 0.203777147 0.205141614 0.215520383 0.222839311 0.236749080 0.259268243 0.276999131 0.301654697 0.312748600 0.354200314 0.377790525 0.397795285 0.441139430 0.476229576 0.532116692 0.554418389 0.566660849 0.605121664 0.609531550 0.638764808 0.701683005 0.754595747 0.760974485 0.767303530 0.770991320 0.777637085 0.781024505 0.782077563 0.790827181 0.792507398 0.798061144 0.809994763 0.813121073 0.823628036 0.826133626 0.843422894 0.850156734 0.854786363 0.877723333 0.882458091 0.902150821 0.904713879 0.917488093 0.918865840 0.920990845 0.926802163 0.933150803 1.061800708 1.156326947 1.322534735 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:-4.5887,-3.3589,2.6936;-5.0904,-3.5254,3.6614;-4.1165,-4.3113,2.398;-5.3598,-3.1174,1.9391;-3.5477,-2.2459,2.7955;-2.958,-2.2019,1.8622;-2.8291,-2.4937,3.5988;-4.1353,-.854,3.0483;-4.7589,-.5542,2.186;-3.311,-.1202,3.1093;-4.9957,-.7339,4.3197;-5.9059,-1.3488,4.2339;-5.306,.319,4.4383;-4.2428,-1.1677,5.5476;-2.199,-.8305,7.0104;-1.7764,-1.6883,6.4566;-2.509,-1.2478,7.9877;-1.1245,.2393,7.2142;-1.5922,1.1496,7.6326;-.7123,.5349,6.2302;.0171,-.1889,8.138;-.3942,-.4101,9.1424;.7054,.6673,8.2704;.819,-1.3959,7.6481;1.1677,-1.2045,6.6149;.1625,-2.2832,7.5917;2.0154,-1.7157,8.5414;1.691,-1.9354,9.5749;2.5722,-2.5935,8.1704;2.7194,-.8647,8.5869;-4.4648,-2.3592,6.0009;-4.6033,-2.2181,7.1028;-3.4011,-.3055,6.2502;-3.3114,.704,5.8306;-3.9867,3.2675,9.19;-4.6601,3.2411,10.0645;-4.0231,4.2853,8.7664;-2.9595,3.0916,9.5548;-4.3846,2.2204,8.1535;-5.4026,2.4364,7.7803;-3.7134,2.3021,7.2818;-4.3419,.8018,8.7117;-4.9926,.7436,9.6067;-3.3323,.5342,9.0685;-4.8597,-.2915,7.8024;-4.8075,-1.4939,8.2067;-5.7292,.0212,7.1809; -739.264436516937 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000623608034 0.000154493462 0.036612923429 0.008435191539 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085163193 -0.000081675 0.000066430 0.000220117 0.000337071 0.000483185 0.000571625 0.000801902 0.001001223 0.001060767 0.001534052 0.001707543 0.002818547 0.002954036 0.003772351 0.004092624 0.004652814 0.005062901 0.007021412 0.007921703 0.009348250 0.010043959 0.011226690 0.013100131 0.017067030 0.020528476 0.020836138 0.022922338 0.024846894 0.029059677 0.029736641 0.032394383 0.035315788 0.038767773 0.039456642 0.040027267 0.040382484 0.042892980 0.045457701 0.049832779 0.050353409 0.050792589 0.051976275 0.052960779 0.053310439 0.054089889 0.055695711 0.059952656 0.061974042 0.064919425 0.065586097 0.067164874 0.070339445 0.075692070 0.076354890 0.077217864 0.077894940 0.080560111 0.081656782 0.083027547 0.090396805 0.091783674 0.100427667 0.103606262 0.109075342 0.111567005 0.113265320 0.113868506 0.115679780 0.117295407 0.118722918 0.123360543 0.131714948 0.134588277 0.139703106 0.143063211 0.149319189 0.153438868 0.154639804 0.159839076 0.163910487 0.172179329 0.183753795 0.187736953 0.197636580 0.203778056 0.205180026 0.215563595 0.222852700 0.236815021 0.259285701 0.277015061 0.301655440 0.312783147 0.354213531 0.377811478 0.397795546 0.441139735 0.476232764 0.532123005 0.554420705 0.566663847 0.605121823 0.609533994 0.638765821 0.701682731 0.754597530 0.760974726 0.767304857 0.770992326 0.777643315 0.781024600 0.782077613 0.790827927 0.792515405 0.798062738 0.809995533 0.813121207 0.823628858 0.826133682 0.843422893 0.850161843 0.854796775 0.877754478 0.882457863 0.902151522 0.904726338 0.917497182 0.918877472 0.920991338 0.926803079 0.933152307 1.061800761 1.156327059 1.322535072 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:-4.6136,-3.3597,2.6899;-5.113,-3.5205,3.6599;-4.1531,-4.3174,2.3924;-5.3852,-3.1097,1.9387;-3.5599,-2.258,2.7875;-2.9732,-2.2207,1.8519;-2.8412,-2.5134,3.5883;-4.1316,-.8595,3.0416;-4.755,-.5536,2.1812;-3.2993,-.1343,3.0989;-4.9866,-.7283,4.3155;-5.9022,-1.3358,4.2345;-5.2874,.3278,4.4316;-4.2332,-1.1646,5.5422;-2.1917,-.8277,7.0088;-1.7657,-1.6827,6.4529;-2.5035,-1.2492,7.9839;-1.1201,.2439,7.219;-1.5911,1.1524,7.6381;-.7051,.5428,6.237;.0193,-.184,8.1456;-.3939,-.4047,9.149;.7072,.6719,8.2787;.8217,-1.3916,7.6584;1.1687,-1.2027,6.625;.1663,-2.279,7.6051;2.0189,-1.709,8.5505;1.6969,-1.9236,9.5847;2.5741,-2.5888,8.183;2.7228,-.8591,8.5906;-4.4538,-2.3575,5.9922;-4.5947,-2.2188,7.0949;-3.3932,-.303,6.2475;-3.3043,.7077,5.8307;-3.9887,3.2627,9.1939;-4.6559,3.2311,10.0741;-4.0324,4.2821,8.7742;-2.9573,3.0885,9.5505;-4.3906,2.218,8.1554;-5.4122,2.4333,7.789;-3.7246,2.3036,7.2792;-4.3407,.7979,8.7092;-4.9896,.7342,9.6053;-3.3293,.5334,9.0634;-4.855,-.2948,7.7971;-4.8011,-1.4979,8.1992;-5.7242,.0173,7.1748; -739.264435468167 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000557102004 0.000157399216 0.035768925968 0.008303951909 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085163033 -0.000084542 0.000070675 0.000220155 0.000337971 0.000501186 0.000581825 0.000871507 0.001016818 0.001068016 0.001538241 0.001708142 0.002821325 0.002954096 0.003772866 0.004105313 0.004653508 0.005062924 0.007022017 0.007923845 0.009348020 0.010045059 0.011227426 0.013100383 0.017067503 0.020528945 0.020836077 0.022922324 0.024846831 0.029059913 0.029736682 0.032394635 0.035315960 0.038767752 0.039456671 0.040027172 0.040382449 0.042893348 0.045457650 0.049832726 0.050353198 0.050792736 0.051975831 0.052959702 0.053310807 0.054089885 0.055695213 0.059952991 0.061975226 0.064918540 0.065586863 0.067164877 0.070339502 0.075697132 0.076359362 0.077226643 0.077894754 0.080564247 0.081657245 0.083028145 0.090397137 0.091790189 0.100427633 0.103606430 0.109075488 0.111566976 0.113265937 0.113868631 0.115679858 0.117297388 0.118722886 0.123360518 0.131715963 0.134588437 0.139703068 0.143065570 0.149318970 0.153438909 0.154638303 0.159840612 0.163910143 0.172179606 0.183756983 0.187741428 0.197651237 0.203778032 0.205244208 0.215581311 0.222902733 0.236880205 0.259302464 0.277053719 0.301658915 0.312812338 0.354234698 0.377854250 0.397796617 0.441140717 0.476234584 0.532125621 0.554424163 0.566670582 0.605121879 0.609535195 0.638768302 0.701683685 0.754599514 0.760976277 0.767306778 0.770994879 0.777653724 0.781024653 0.782078144 0.790828688 0.792535438 0.798063434 0.809995715 0.813121170 0.823630786 0.826134421 0.843422901 0.850166382 0.854807897 0.877790200 0.882464434 0.902158928 0.904745082 0.917505904 0.918877566 0.920995060 0.926811062 0.933152251 1.061801735 1.156327053 1.322534520 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:-4.6381,-3.3609,2.6876;-5.1361,-3.516,3.6592;-4.1889,-4.3236,2.3889;-5.4094,-3.1028,1.9387;-3.5721,-2.2706,2.7815;-2.9879,-2.2403,1.844;-2.8539,-2.5334,3.5802;-4.1278,-.8656,3.036;-4.7504,-.554,2.1771;-3.2874,-.1493,3.0899;-4.9779,-.7231,4.3122;-5.8987,-1.3235,4.2355;-5.2696,.3359,4.4253;-4.2248,-1.1613,5.5383;-2.1867,-.8245,7.01;-1.76,-1.6797,6.4555;-2.4992,-1.2453,7.9847;-1.1157,.247,7.2209;-1.5871,1.1556,7.6385;-.6996,.5454,6.2395;.0224,-.1804,8.1492;-.3932,-.4055,9.1509;.7076,.6772,8.2872;.83,-1.384,7.6602;1.1832,-1.1888,6.6293;.1763,-2.273,7.5981;2.0229,-1.7029,8.5582;1.6941,-1.9263,9.5894;2.5839,-2.578,8.1875;2.724,-.85,8.6095;-4.4443,-2.3556,5.9853;-4.5887,-2.2188,7.0885;-3.3872,-.3001,6.2468;-3.299,.7116,5.8324;-3.9947,3.2589,9.1991;-4.6705,3.2279,10.0715;-4.0324,4.2781,8.7792;-2.9679,3.0842,9.5661;-4.3875,2.2147,8.1572;-5.4052,2.4296,7.782;-3.714,2.3014,7.2877;-4.3427,.794,8.7097;-4.9971,.7298,9.6015;-3.3339,.5283,9.07;-4.853,-.2971,7.7933;-4.7986,-1.5012,8.1927;-5.7209,.0153,7.1694; -739.264434066833 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000658616007 0.000144902418 0.035876300669 0.009048541650 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085162876 -0.000078899 0.000079056 0.000220179 0.000338966 0.000499110 0.000579154 0.000883129 0.001037145 0.001135245 0.001551180 0.001710077 0.002826686 0.002954107 0.003774148 0.004143996 0.004654126 0.005062950 0.007021907 0.007924918 0.009347800 0.010051180 0.011228308 0.013100286 0.017067647 0.020529306 0.020836087 0.022922329 0.024846802 0.029059990 0.029736694 0.032394637 0.035317086 0.038767791 0.039456978 0.040027176 0.040382429 0.042893282 0.045457645 0.049832817 0.050352921 0.050792790 0.051975412 0.052958957 0.053310498 0.054089596 0.055693281 0.059953133 0.061974814 0.064919376 0.065586995 0.067166326 0.070342224 0.075699776 0.076357694 0.077234938 0.077894882 0.080568038 0.081659308 0.083029464 0.090397218 0.091797576 0.100427611 0.103606781 0.109075673 0.111567281 0.113266072 0.113868369 0.115680257 0.117300531 0.118723118 0.123360742 0.131716218 0.134588390 0.139703601 0.143065803 0.149318769 0.153437877 0.154641610 0.159840462 0.163910754 0.172182193 0.183759551 0.187743166 0.197690018 0.203777715 0.205261725 0.215661233 0.222913001 0.236886202 0.259322002 0.277057746 0.301660027 0.312884081 0.354243314 0.377891953 0.397796845 0.441140813 0.476234730 0.532128139 0.554425276 0.566675283 0.605124742 0.609535213 0.638772654 0.701686574 0.754599530 0.760980111 0.767314030 0.770998429 0.777667549 0.781024748 0.782081446 0.790834242 0.792549864 0.798064493 0.809995620 0.813121136 0.823635567 0.826136323 0.843423106 0.850166560 0.854810349 0.877814288 0.882473666 0.902165824 0.904754742 0.917528944 0.918879416 0.920997434 0.926810884 0.933152692 1.061801918 1.156327042 1.322535058 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:-4.6642,-3.3611,2.6807;-5.1599,-3.5129,3.6538;-4.2248,-4.327,2.3798;-5.4356,-3.0955,1.9346;-3.5888,-2.281,2.7719;-3.0078,-2.2551,1.8326;-2.8705,-2.5509,3.5682;-4.1308,-.8719,3.0287;-4.7546,-.5554,2.1724;-3.2845,-.1631,3.0784;-4.9732,-.7213,4.3086;-5.8975,-1.3166,4.2375;-5.2584,.339,4.4204;-4.217,-1.1607,5.5325;-2.1784,-.8239,7.004;-1.745,-1.6725,6.4433;-2.4933,-1.2546,7.9745;-1.1131,.2522,7.2283;-1.5914,1.1559,7.6499;-.6923,.5592,6.2509;.0219,-.1754,8.1606;-.3973,-.403,9.1601;.7051,.6831,8.3029;.8332,-1.3769,7.6729;1.1866,-1.1813,6.6428;.182,-2.2669,7.6107;2.0257,-1.6931,8.5719;1.6975,-1.9137,9.6029;2.5871,-2.569,8.2043;2.7258,-.8405,8.6205;-4.4348,-2.3558,5.9781;-4.5795,-2.2205,7.0816;-3.3791,-.2997,6.2412;-3.292,.7126,5.8281;-3.9953,3.2542,9.2027;-4.6731,3.2186,10.074;-4.0349,4.2749,8.7858;-2.9685,3.0806,9.5715;-4.3826,2.2122,8.1565;-5.4004,2.4257,7.7797;-3.7075,2.303,7.2882;-4.335,.7902,8.7057;-4.9884,.7234,9.5982;-3.3254,.5246,9.064;-4.8449,-.2997,7.7881;-4.7894,-1.5041,8.1862;-5.7131,.0129,7.165; -739.264429260661 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000819853630 0.000172803368 0.036052206604 0.008416585995 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085162852 -0.000199229 0.000081145 0.000220425 0.000357150 0.000520034 0.000615954 0.000882530 0.001044393 0.001284565 0.001574904 0.001710626 0.002836361 0.002954129 0.003777094 0.004203126 0.004653970 0.005063171 0.007022299 0.007924513 0.009348003 0.010063198 0.011229629 0.013100761 0.017067600 0.020529878 0.020836196 0.022922256 0.024846774 0.029059990 0.029736673 0.032394616 0.035320910 0.038767995 0.039457336 0.040028026 0.040382450 0.042894381 0.045457556 0.049833321 0.050353019 0.050793496 0.051974880 0.052958121 0.053310393 0.054089698 0.055702358 0.059953060 0.061974621 0.064935022 0.065586936 0.067167560 0.070344696 0.075700564 0.076356942 0.077236881 0.077894963 0.080568804 0.081660119 0.083030057 0.090399759 0.091805626 0.100427769 0.103606771 0.109076124 0.111568355 0.113267692 0.113868258 0.115681183 0.117305235 0.118723328 0.123360892 0.131716792 0.134588592 0.139704460 0.143065771 0.149319994 0.153443196 0.154648711 0.159839989 0.163910801 0.172187625 0.183767518 0.187743137 0.197808920 0.203778234 0.205266932 0.215699135 0.222912997 0.236883012 0.259324660 0.277057728 0.301661958 0.312982124 0.354260951 0.377915453 0.397798069 0.441141934 0.476237064 0.532128093 0.554426587 0.566683686 0.605132830 0.609536304 0.638789865 0.701700364 0.754599630 0.760997954 0.767329793 0.770999920 0.777697882 0.781026305 0.782083120 0.790839281 0.792549926 0.798066042 0.810001312 0.813122073 0.823636681 0.826136457 0.843423074 0.850168785 0.854811105 0.877839290 0.882488834 0.902168971 0.904754585 0.917556548 0.918880747 0.920999338 0.926810853 0.933160189 1.061802029 1.156327148 1.322538221 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:-4.6873,-3.361,2.6809;-5.1795,-3.5065,3.6572;-4.2608,-4.3328,2.377;-5.4603,-3.0865,1.9392;-3.5981,-2.2926,2.7662;-3.0204,-2.2746,1.8241;-2.8793,-2.5697,3.5596;-4.1234,-.8761,3.0237;-4.7457,-.5528,2.1689;-3.2682,-.1767,3.0708;-4.9624,-.7138,4.3051;-5.8929,-1.3008,4.2374;-5.237,.3504,4.4139;-4.2079,-1.1565,5.5287;-2.1732,-.8197,7.0062;-1.7425,-1.6715,6.4505;-2.4867,-1.2449,7.9782;-1.1064,.2538,7.2237;-1.5823,1.1612,7.6381;-.6855,.5532,6.2452;.0268,-.1711,8.1592;-.3948,-.3975,9.1579;.7086,.6881,8.302;.8409,-1.3722,7.6754;1.2013,-1.1751,6.6473;.1897,-2.2624,7.6076;2.0278,-1.6889,8.5824;1.6915,-1.9149,9.6107;2.5945,-2.5617,8.2148;2.726,-.834,8.6405;-4.4247,-2.3533,5.9701;-4.5729,-2.2208,7.0743;-3.3731,-.2962,6.2418;-3.287,.7176,5.832;-4.0001,3.2493,9.2071;-4.673,3.2103,10.0822;-4.0447,4.2707,8.7927;-2.9707,3.0771,9.5698;-4.3908,2.2089,8.1605;-5.4106,2.4221,7.7883;-3.7194,2.3022,7.2895;-4.3392,.7858,8.7064;-4.9941,.7144,9.5976;-3.3294,.5233,9.0662;-4.8433,-.3035,7.7846;-4.7858,-1.5091,8.1797;-5.7109,.008,7.1599; -739.264424314001 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001156588814 0.000248762851 0.038056687164 0.008289092028 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085162711 -0.000186049 0.000080969 0.000222354 0.000357298 0.000528577 0.000641248 0.000883969 0.001046213 0.001443975 0.001607826 0.001712313 0.002852718 0.002954299 0.003778566 0.004273297 0.004654723 0.005063707 0.007023048 0.007931676 0.009349947 0.010074450 0.011231670 0.013105490 0.017068263 0.020530794 0.020836097 0.022922314 0.024846782 0.029060025 0.029736693 0.032395673 0.035328939 0.038768153 0.039457615 0.040031276 0.040382706 0.042897967 0.045457933 0.049833786 0.050355297 0.050793850 0.051974769 0.052956774 0.053310081 0.054090783 0.055748772 0.059953202 0.061975248 0.064982226 0.065586586 0.067168243 0.070347032 0.075701910 0.076364289 0.077238042 0.077901735 0.080569089 0.081659527 0.083029884 0.090409915 0.091819410 0.100428246 0.103606663 0.109077936 0.111571025 0.113271837 0.113869556 0.115684330 0.117313960 0.118723533 0.123363150 0.131716660 0.134588278 0.139704788 0.143065518 0.149325583 0.153461835 0.154657465 0.159845751 0.163913274 0.172204586 0.183785881 0.187748504 0.198021252 0.203782349 0.205266629 0.215788701 0.222944062 0.236927579 0.259325820 0.277068301 0.301683567 0.313199974 0.354270435 0.377921424 0.397812976 0.441146879 0.476251079 0.532128164 0.554437676 0.566690295 0.605145499 0.609538110 0.638827046 0.701709107 0.754600120 0.761052463 0.767362592 0.770999852 0.777742024 0.781026315 0.782083957 0.790844369 0.792568177 0.798066975 0.810030169 0.813122382 0.823637555 0.826136870 0.843423168 0.850175111 0.854819701 0.877862424 0.882536202 0.902169953 0.904769218 0.917579653 0.918880628 0.921005643 0.926812693 0.933168103 1.061804617 1.156329402 1.322544391 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:-4.6616,-3.3607,2.6834;-5.157,-3.5119,3.657;-4.2228,-4.3273,2.3823;-5.4335,-3.0951,1.9377;-3.5855,-2.2806,2.7737;-3.0043,-2.2556,1.8342;-2.8672,-2.5501,3.57;-4.1273,-.8708,3.0298;-4.7501,-.5539,2.173;-3.2805,-.1622,3.0804;-4.9715,-.7196,4.3088;-5.8965,-1.3142,4.2366;-5.2558,.3414,4.4201;-4.2171,-1.1596,5.5334;-2.1798,-.8229,7.0068;-1.7498,-1.6749,6.4499;-2.4932,-1.2481,7.9793;-1.1119,.2507,7.2238;-1.5869,1.1575,7.6414;-.6928,.5518,6.2446;.0236,-.1758,8.1558;-.3951,-.4018,9.1559;.7071,.6825,8.2965;.8343,-1.3782,7.6693;1.1898,-1.1826,6.6395;.1821,-2.2678,7.6057;2.0251,-1.6954,8.5705;1.6942,-1.9183,9.6008;2.5879,-2.5702,8.2021;2.725,-.842,8.6228;-4.4352,-2.355,5.9782;-4.5808,-2.22,7.0818;-3.3802,-.2988,6.2434;-3.293,.7137,5.8308;-3.9962,3.2542,9.2026;-4.6705,3.2188,10.0766;-4.0377,4.2747,8.7857;-2.9679,3.0808,9.5672;-4.3877,2.2121,8.1581;-5.4067,2.4261,7.7846;-3.7155,2.3023,7.2876;-4.3391,.7902,8.7073;-4.9928,.7226,9.5995;-3.3294,.5259,9.0662;-4.8473,-.3,7.7889;-4.7915,-1.5047,8.1866;-5.7153,.012,7.1651; -739.264433117708 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000264001201 0.000059162254 0.027383450310 0.008443959372 0.000300000000 0.000200000000 0.001704537703 0.001136358469 -0.085163174 -0.000004788 0.000057895 0.000220627 0.000295732 0.000478260 0.000552781 0.000883847 0.001044530 0.001373668 0.001553125 0.001714388 0.002857816 0.002954670 0.003781443 0.004316599 0.004656390 0.005063489 0.007022892 0.007934972 0.009352098 0.010081780 0.011233661 0.013106613 0.017068339 0.020532504 0.020836571 0.022922603 0.024846928 0.029060202 0.029736733 0.032396224 0.035339583 0.038768656 0.039458140 0.040035668 0.040382857 0.042900456 0.045458099 0.049833725 0.050356967 0.050794323 0.051975529 0.052959114 0.053310163 0.054094352 0.055791582 0.059953376 0.061976089 0.065033705 0.065587083 0.067168418 0.070349562 0.075704150 0.076370869 0.077239488 0.077907095 0.080568053 0.081659331 0.083030506 0.090420855 0.091835101 0.100428857 0.103606707 0.109080316 0.111573931 0.113276032 0.113871033 0.115687338 0.117323437 0.118723916 0.123365527 0.131716883 0.134588711 0.139705696 0.143065714 0.149331146 0.153477134 0.154667060 0.159849756 0.163916385 0.172217912 0.183806833 0.187752030 0.198247225 0.203787164 0.205266150 0.215866433 0.222958048 0.236964216 0.259328592 0.277073364 0.301700690 0.313382409 0.354285100 0.377928889 0.397825384 0.441150541 0.476262036 0.532129006 0.554445627 0.566697932 0.605156070 0.609539731 0.638857653 0.701718548 0.754600961 0.761088328 0.767386263 0.770999841 0.777777762 0.781026518 0.782084595 0.790847954 0.792578975 0.798068222 0.810052045 0.813123239 0.823638109 0.826137221 0.843423266 0.850179835 0.854826047 0.877880801 0.882567923 0.902171162 0.904779149 0.917596645 0.918884343 0.921010587 0.926814306 0.933176144 1.061806128 1.156330916 1.322549359 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:-4.6406,-3.3616,2.6894;-5.1406,-3.5145,3.6604;-4.1954,-4.3265,2.3913;-5.41,-3.0999,1.9397;-3.5699,-2.2758,2.7847;-2.9834,-2.2487,1.8485;-2.8545,-2.5413,3.5851;-4.1201,-.8679,3.0367;-4.7392,-.5542,2.1761;-3.2767,-.1551,3.0921;-4.9729,-.7206,4.3106;-5.8955,-1.3185,4.2328;-5.2616,.3396,4.4215;-4.2234,-1.1592,5.5386;-2.187,-.8242,7.0128;-1.7594,-1.6786,6.4571;-2.5014,-1.2467,7.9868;-1.1161,.2477,7.2269;-1.588,1.1541,7.6497;-.7015,.551,6.2459;.0239,-.1827,8.1512;-.3893,-.4119,9.1529;.709,.6748,8.2908;.8308,-1.3842,7.6559;1.181,-1.1852,6.625;.1776,-2.2731,7.5925;2.0257,-1.7061,8.5494;1.7003,-1.9324,9.5804;2.5852,-2.5804,8.1749;2.7269,-.8539,8.6007;-4.4446,-2.3534,5.9852;-4.5898,-2.2172,7.0881;-3.3863,-.2987,6.2486;-3.2968,.713,5.8345;-4.0013,3.2612,9.1994;-4.6745,3.2272,10.0743;-4.0436,4.281,8.7807;-2.9726,3.0889,9.5632;-4.3938,2.2171,8.1574;-5.413,2.4303,7.7847;-3.7224,2.3057,7.2861;-4.3447,.7961,8.7092;-4.9975,.7302,9.6022;-3.3346,.5323,9.0674;-4.8541,-.2954,7.793;-4.7999,-1.4993,8.1928;-5.7214,.0166,7.1681; -739.264434241254 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000566642680 0.000127762166 0.037840636096 0.008393227192 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085163827 -0.000000050 0.000046657 0.000220999 0.000321551 0.000493265 0.000556801 0.000885258 0.001046005 0.001379881 0.001539075 0.001751135 0.002864500 0.002955251 0.003786131 0.004372269 0.004656625 0.005063498 0.007023091 0.007941503 0.009352772 0.010080628 0.011234026 0.013105910 0.017067441 0.020535828 0.020836654 0.022922673 0.024846910 0.029060256 0.029736998 0.032396405 0.035343343 0.038769991 0.039458206 0.040039312 0.040383879 0.042901619 0.045458267 0.049836298 0.050358279 0.050794767 0.051977701 0.052961148 0.053315750 0.054103384 0.055806451 0.059954679 0.061990584 0.065034303 0.065588649 0.067169573 0.070357038 0.075722899 0.076373401 0.077239721 0.077907735 0.080576537 0.081658863 0.083029999 0.090423793 0.091849313 0.100429053 0.103606624 0.109082375 0.111574334 0.113276549 0.113881047 0.115687933 0.117329701 0.118723803 0.123365876 0.131719270 0.134590608 0.139709039 0.143065946 0.149332718 0.153487914 0.154669547 0.159850743 0.163921641 0.172227930 0.183831397 0.187751928 0.198320815 0.203787309 0.205303427 0.215874545 0.222971584 0.236965846 0.259328546 0.277107872 0.301703959 0.313402303 0.354317062 0.377939406 0.397826050 0.441150928 0.476265452 0.532131984 0.554445711 0.566716777 0.605160590 0.609540093 0.638871649 0.701721410 0.754611291 0.761093865 0.767388189 0.771000390 0.777787131 0.781026687 0.782090204 0.790849364 0.792579437 0.798074179 0.810078955 0.813125208 0.823641077 0.826138505 0.843424161 0.850180768 0.854830081 0.877889060 0.882633288 0.902186940 0.904784052 0.917605399 0.918886162 0.921029589 0.926817128 0.933182164 1.061806959 1.156331044 1.322555876 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:-4.6159,-3.3599,2.6905;-5.1163,-3.5196,3.6601;-4.1576,-4.3186,2.3931;-5.3866,-3.108,1.9388;-3.5597,-2.2608,2.7889;-2.9721,-2.2251,1.8538;-2.8422,-2.5178,3.5903;-4.1282,-.8609,3.0421;-4.75,-.5538,2.181;-3.2942,-.1377,3.1;-4.984,-.7272,4.3152;-5.9004,-1.3335,4.2339;-5.2833,.3294,4.4301;-4.2322,-1.1634,5.5428;-2.1922,-.8269,7.0114;-1.7679,-1.6839,6.4575;-2.504,-1.2455,7.9876;-1.119,.2436,7.2185;-1.5885,1.1529,7.6375;-.7056,.541,6.2355;.0216,-.1846,8.1434;-.3905,-.4066,9.1471;.7092,.6717,8.2769;.8246,-1.391,7.6541;1.1738,-1.199,6.6215;.1689,-2.2783,7.5968;2.0203,-1.7109,8.5479;1.6956,-1.9304,9.5807;2.5771,-2.5887,8.1777;2.7237,-.8604,8.5935;-4.4533,-2.3564,5.9926;-4.5951,-2.2179,7.0951;-3.393,-.3019,6.2492;-3.3038,.7088,5.8326;-3.9947,3.2639,9.1957;-4.6666,3.2325,10.0718;-4.0358,4.283,8.7753;-2.9656,3.0901,9.5581;-4.3907,2.2186,8.156;-5.4103,2.433,7.7846;-3.7206,2.3046,7.2833;-4.3429,.7986,8.7102;-4.9937,.7355,9.6049;-3.3324,.5337,9.0665;-4.8562,-.294,7.7975;-4.8025,-1.4971,8.1994;-5.7248,.0181,7.1744; -739.264437218973 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000179108590 0.000050790026 0.033262714846 0.008438416233 0.000300000000 0.000200000000 0.002512442307 0.001674961538 -0.085164143 0.000019007 0.000075848 0.000223075 0.000314690 0.000502740 0.000553433 0.000851696 0.001046751 0.001276668 0.001536203 0.001750504 0.002859407 0.002954483 0.003786691 0.004376256 0.004656644 0.005063661 0.007023098 0.007946808 0.009352793 0.010083322 0.011234199 0.013106412 0.017068309 0.020536270 0.020836725 0.022922734 0.024846941 0.029060669 0.029736939 0.032396892 0.035343803 0.038770173 0.039458488 0.040039470 0.040383994 0.042902758 0.045458110 0.049836325 0.050358252 0.050794378 0.051978158 0.052962017 0.053315762 0.054104574 0.055808763 0.059955483 0.061992449 0.065036066 0.065590105 0.067170257 0.070356510 0.075726421 0.076378796 0.077243030 0.077906966 0.080581309 0.081660204 0.083031255 0.090424289 0.091851949 0.100429459 0.103607112 0.109082832 0.111574521 0.113278040 0.113881477 0.115687886 0.117330545 0.118723733 0.123365880 0.131720416 0.134590970 0.139709356 0.143068727 0.149333415 0.153492754 0.154674126 0.159851989 0.163921802 0.172228472 0.183835309 0.187754676 0.198328503 0.203787631 0.205336849 0.215862807 0.223007842 0.236986684 0.259333432 0.277130124 0.301706762 0.313399864 0.354326767 0.377958176 0.397827328 0.441150370 0.476266369 0.532131168 0.554448252 0.566719179 0.605161995 0.609540158 0.638873323 0.701723178 0.754611760 0.761096410 0.767388138 0.771001981 0.777789056 0.781026980 0.782090860 0.790849748 0.792589883 0.798074396 0.810079466 0.813125320 0.823643469 0.826139419 0.843424545 0.850182617 0.854833997 0.877894492 0.882636489 0.902192705 0.904788332 0.917606787 0.918890390 0.921030781 0.926820075 0.933182473 1.061807671 1.156331162 1.322556900 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:-4.5921,-3.3606,2.6964;-5.0962,-3.5226,3.6641;-4.1243,-4.316,2.4032;-5.3608,-3.1168,1.9403;-3.5456,-2.2524,2.7977;-2.9545,-2.2129,1.8648;-2.8293,-2.5021,3.6024;-4.1269,-.8572,3.0475;-4.7474,-.5556,2.1836;-3.299,-.1272,3.1086;-4.9892,-.7303,4.317;-5.9025,-1.3409,4.2308;-5.2943,.3248,4.4328;-4.2406,-1.1651,5.5471;-2.2008,-.8298,7.016;-1.7773,-1.6876,6.4627;-2.5135,-1.2472,7.9924;-1.1263,.2394,7.2228;-1.5936,1.1478,7.646;-.716,.5395,6.2393;.0173,-.1924,8.1425;-.3919,-.4201,9.1464;.7045,.6641,8.2786;.8201,-1.3953,7.6438;1.1631,-1.1984,6.6102;.166,-2.284,7.5866;2.0214,-1.716,8.5293;1.7031,-1.9407,9.563;2.5784,-2.5909,8.152;2.723,-.8635,8.5747;-4.4648,-2.3567,5.9993;-4.6064,-2.2158,7.101;-3.4005,-.3038,6.2526;-3.3088,.7058,5.8337;-3.9903,3.2686,9.1912;-4.6634,3.2423,10.0663;-4.027,4.2867,8.768;-2.9624,3.0921,9.5555;-4.3891,2.2221,8.1538;-5.4072,2.4394,7.7802;-3.7174,2.3031,7.2821;-4.3477,.8033,8.7116;-5.0003,.7448,9.6053;-3.3389,.5356,9.0705;-4.8637,-.2896,7.8006;-4.8134,-1.4922,8.2045;-5.7313,.0238,7.1766; -739.264437744147 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000357009400 0.000090983102 0.029563607913 0.008374613675 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085164359 0.000012768 0.000056589 0.000220124 0.000321220 0.000520654 0.000558923 0.000857803 0.001052429 0.001277336 0.001535976 0.001746611 0.002860173 0.002954364 0.003788800 0.004376855 0.004657709 0.005065690 0.007022988 0.007948548 0.009353134 0.010084126 0.011234268 0.013106752 0.017070072 0.020536068 0.020836822 0.022922710 0.024846917 0.029061323 0.029736971 0.032397234 0.035344029 0.038770890 0.039458853 0.040040490 0.040384734 0.042903123 0.045458064 0.049836493 0.050358234 0.050794741 0.051978723 0.052962688 0.053315609 0.054105164 0.055806912 0.059955672 0.061991585 0.065036028 0.065591363 0.067175564 0.070357643 0.075725460 0.076381153 0.077244576 0.077906996 0.080580747 0.081660746 0.083034135 0.090425654 0.091851895 0.100430286 0.103607281 0.109082840 0.111574819 0.113280996 0.113882461 0.115687950 0.117330485 0.118723812 0.123366884 0.131721068 0.134591626 0.139709705 0.143072637 0.149334632 0.153499525 0.154685207 0.159852744 0.163922620 0.172228668 0.183838087 0.187754865 0.198327888 0.203787836 0.205340055 0.215877386 0.223007565 0.236991138 0.259339877 0.277128900 0.301706785 0.313404481 0.354325061 0.377959908 0.397828383 0.441151048 0.476270332 0.532132691 0.554448804 0.566719372 0.605169419 0.609540100 0.638876631 0.701726661 0.754613411 0.761100768 0.767388388 0.771001953 0.777789171 0.781027089 0.782091780 0.790851150 0.792589779 0.798075299 0.810080359 0.813126872 0.823651691 0.826139518 0.843426132 0.850185153 0.854836444 0.877897565 0.882644342 0.902192964 0.904790055 0.917609661 0.918901457 0.921033323 0.926820483 0.933184666 1.061808410 1.156332043 1.322558098 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:-4.5701,-3.3595,2.6984;-5.0805,-3.526,3.6614;-4.0947,-4.3117,2.4076;-5.3345,-3.1186,1.9368;-3.5308,-2.246,2.8091;-2.9327,-2.2021,1.8814;-2.8194,-2.4931,3.6192;-4.1215,-.8543,3.0557;-4.7383,-.5556,2.188;-3.2984,-.1198,3.1228;-4.992,-.7341,4.32;-5.9006,-1.35,4.2277;-5.3044,.3184,4.4355;-4.2474,-1.1662,5.5534;-2.2082,-.8307,7.0223;-1.7886,-1.6926,6.4723;-2.5204,-1.2425,8.0013;-1.1299,.2359,7.2216;-1.5928,1.1458,7.6464;-.7246,.5337,6.2353;.0186,-.1976,8.1344;-.3844,-.4245,9.1405;.7076,.6576,8.2659;.817,-1.4015,7.6314;1.1564,-1.204,6.5967;.1609,-2.2885,7.5757;2.0211,-1.7262,8.5122;1.7065,-1.9514,9.5468;2.5745,-2.6017,8.1318;2.7249,-.8759,8.5556;-4.4739,-2.3564,6.008;-4.6149,-2.2136,7.1087;-3.4074,-.3043,6.2583;-3.314,.7042,5.8373;-3.9929,3.2748,9.1884;-4.6643,3.2508,10.0651;-4.0293,4.2923,8.7635;-2.9645,3.0977,9.5508;-4.395,2.227,8.1536;-5.4137,2.4448,7.7817;-3.7249,2.3055,7.2802;-4.3541,.8092,8.714;-5.0063,.7527,9.6081;-3.3452,.5414,9.0728;-4.8708,-.2853,7.8053;-4.8218,-1.4869,8.2118;-5.7378,.0278,7.1803; -739.264437148979 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000344552465 0.000084524177 0.036951192049 0.008390489824 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085164478 -0.000057837 0.000084175 0.000222726 0.000321875 0.000548955 0.000589030 0.000863837 0.001060813 0.001284601 0.001536058 0.001751663 0.002860812 0.002954594 0.003793316 0.004377852 0.004657800 0.005067320 0.007023019 0.007950777 0.009353529 0.010085780 0.011234866 0.013107524 0.017071230 0.020536166 0.020837038 0.022922745 0.024846985 0.029061437 0.029737199 0.032398201 0.035344163 0.038771038 0.039459038 0.040041140 0.040385724 0.042904433 0.045458423 0.049836561 0.050358345 0.050795008 0.051979506 0.052963421 0.053315884 0.054106241 0.055808426 0.059955800 0.061991755 0.065036941 0.065591647 0.067179158 0.070357586 0.075725517 0.076382679 0.077245467 0.077906986 0.080581312 0.081660945 0.083035547 0.090425621 0.091852469 0.100431499 0.103607488 0.109082910 0.111574974 0.113281970 0.113882964 0.115688134 0.117330777 0.118724531 0.123367102 0.131722070 0.134592269 0.139710373 0.143073162 0.149335898 0.153508155 0.154695045 0.159855502 0.163923084 0.172229166 0.183839396 0.187754978 0.198329545 0.203788041 0.205340114 0.215890564 0.223007573 0.236999051 0.259340363 0.277129169 0.301708082 0.313412009 0.354325127 0.377960798 0.397829423 0.441152487 0.476272670 0.532138339 0.554448921 0.566720481 0.605174435 0.609540929 0.638878353 0.701731406 0.754615564 0.761111490 0.767389387 0.771001964 0.777789652 0.781027593 0.782092042 0.790853861 0.792590398 0.798078496 0.810082666 0.813128495 0.823660920 0.826139644 0.843427147 0.850185280 0.854836873 0.877898466 0.882648853 0.902193123 0.904796310 0.917623203 0.918917926 0.921036108 0.926822421 0.933185251 1.061809052 1.156332065 1.322558688 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:-4.5456,-3.3583,2.7057;-5.0516,-3.5298,3.6711;-4.0578,-4.3045,2.4147;-5.3152,-3.1298,1.9455;-3.5213,-2.2296,2.8121;-2.926,-2.1787,1.882;-2.8042,-2.4647,3.6207;-4.1311,-.8462,3.0596;-4.7521,-.5554,2.1923;-3.3177,-.1006,3.1268;-5.0032,-.7386,4.3244;-5.9077,-1.3613,4.2299;-5.3237,.3117,4.4446;-4.2558,-1.1698,5.5565;-2.2119,-.8347,7.0187;-1.7934,-1.6962,6.4673;-2.5223,-1.2472,7.9979;-1.133,.2315,7.2171;-1.5952,1.142,7.6412;-.7274,.5282,6.2306;.0145,-.2023,8.1309;-.3896,-.4272,9.1374;.7051,.6523,8.2617;.8106,-1.4085,7.6297;1.1479,-1.2146,6.5936;.1535,-2.2952,7.5781;2.0163,-1.7314,8.5084;1.7036,-1.953,9.5445;2.5679,-2.6089,8.1295;2.721,-.8814,8.5477;-4.4827,-2.3589,6.0139;-4.6198,-2.2142,7.1145;-3.4126,-.3079,6.2574;-3.3191,.6998,5.8342;-3.9908,3.2787,9.183;-4.6661,3.2573,10.0565;-4.0247,4.2948,8.7549;-2.9642,3.1023,9.5505;-4.3885,2.2279,8.1497;-5.4057,2.4446,7.7734;-3.7152,2.3045,7.2788;-4.3496,.8116,8.7139;-5.0003,.7589,9.6093;-3.3406,.5427,9.0715;-4.8707,-.2842,7.8091;-4.8221,-1.4851,8.2177;-5.7393,.0289,7.1864; -739.264435925055 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000676626216 0.000144298482 0.033885073935 0.008129074525 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085164641 -0.000035547 0.000075146 0.000237325 0.000319635 0.000555934 0.000626548 0.000872203 0.001067262 0.001287113 0.001535360 0.001774222 0.002860839 0.002955401 0.003804231 0.004377401 0.004657796 0.005070380 0.007024389 0.007958765 0.009353849 0.010085093 0.011235733 0.013112774 0.017074884 0.020536300 0.020838617 0.022922755 0.024846956 0.029061410 0.029737882 0.032402969 0.035344352 0.038771080 0.039459708 0.040042563 0.040390551 0.042907747 0.045459409 0.049836899 0.050359131 0.050794595 0.051982797 0.052967321 0.053315914 0.054108525 0.055809534 0.059955257 0.061991942 0.065037428 0.065591189 0.067181132 0.070358257 0.075725740 0.076396793 0.077251729 0.077907524 0.080584642 0.081663568 0.083043529 0.090425937 0.091854185 0.100434635 0.103608605 0.109083324 0.111575065 0.113282008 0.113882941 0.115688863 0.117331608 0.118730008 0.123366883 0.131722159 0.134592800 0.139713205 0.143073096 0.149336036 0.153542954 0.154712706 0.159857496 0.163923651 0.172228289 0.183842586 0.187755076 0.198329189 0.203793362 0.205347806 0.215974790 0.223009611 0.237012075 0.259347364 0.277140225 0.301713408 0.313432423 0.354336816 0.377962101 0.397835765 0.441162510 0.476287585 0.532151929 0.554449167 0.566720887 0.605177506 0.609543630 0.638883162 0.701735865 0.754617606 0.761151655 0.767390488 0.771002084 0.777789885 0.781034450 0.782092290 0.790860579 0.792590635 0.798079087 0.810082943 0.813130878 0.823664497 0.826139583 0.843429910 0.850184949 0.854838408 0.877898628 0.882661396 0.902193594 0.904798306 0.917649250 0.918944360 0.921047695 0.926823881 0.933185861 1.061814047 1.156332281 1.322560858 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:-4.5234,-3.3552,2.7025;-5.0334,-3.5355,3.6632;-4.0239,-4.2952,2.4125;-5.2906,-3.132,1.9386;-3.512,-2.2168,2.8181;-2.9124,-2.1566,1.8923;-2.7968,-2.448,3.6295;-4.1367,-.8403,3.0665;-4.7581,-.5536,2.1981;-3.3314,-.0866,3.1382;-5.0127,-.7464,4.329;-5.9094,-1.3784,4.2299;-5.3455,.299,4.4524;-4.2639,-1.1745,5.5614;-2.2171,-.8371,7.0189;-1.8011,-1.7009,6.4694;-2.5256,-1.2458,8.0003;-1.1362,.2282,7.2107;-1.5962,1.1414,7.6316;-.7319,.5201,6.2223;.0125,-.2033,8.124;-.3894,-.422,9.1324;.705,.6503,8.2484;.8051,-1.4137,7.6275;1.1418,-1.2253,6.5901;.1459,-2.299,7.5807;2.0111,-1.7355,8.5065;1.6993,-1.9512,9.5441;2.56,-2.6162,8.1313;2.7181,-.8873,8.5407;-4.4906,-2.3623,6.0221;-4.625,-2.2152,7.1224;-3.4193,-.3113,6.2589;-3.3258,.6952,5.8329;-3.9805,3.2811,9.1772;-4.6486,3.263,10.0565;-4.0156,4.2966,8.7478;-2.9512,3.1028,9.5367;-4.3894,2.2295,8.1488;-5.4091,2.4482,7.7801;-3.7228,2.3025,7.2725;-4.3498,.8141,8.7152;-4.9978,.7632,9.6126;-3.3399,.5452,9.0704;-4.874,-.2829,7.8136;-4.8257,-1.483,8.2246;-5.7434,.0298,7.1919; -739.264436452885 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000370192167 0.000076580842 0.036172663013 0.008321586837 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.085164447 -0.000055799 0.000073329 0.000234454 0.000320022 0.000524933 0.000626102 0.000849725 0.001067596 0.001285998 0.001536454 0.001799447 0.002860633 0.002955874 0.003818767 0.004384444 0.004657653 0.005070112 0.007024416 0.007958212 0.009354550 0.010085517 0.011236318 0.013119103 0.017079257 0.020536321 0.020840710 0.022922925 0.024846832 0.029061471 0.029738238 0.032408672 0.035344313 0.038771094 0.039459447 0.040042391 0.040390415 0.042910296 0.045459687 0.049836762 0.050359235 0.050794330 0.051980940 0.052970415 0.053315940 0.054108768 0.055821130 0.059954113 0.061991969 0.065042887 0.065588081 0.067183316 0.070358817 0.075726226 0.076402948 0.077253461 0.077909570 0.080585308 0.081662557 0.083042655 0.090426785 0.091855036 0.100435327 0.103609113 0.109082942 0.111575111 0.113282645 0.113884138 0.115689401 0.117332473 0.118728409 0.123367089 0.131722574 0.134593087 0.139713075 0.143073126 0.149336666 0.153553686 0.154723228 0.159858757 0.163921211 0.172225604 0.183842915 0.187755351 0.198328363 0.203801443 0.205357172 0.216012347 0.223008519 0.237065290 0.259349602 0.277150481 0.301719900 0.313439182 0.354337579 0.377962575 0.397837376 0.441164772 0.476298691 0.532157438 0.554449199 0.566721983 0.605178403 0.609544853 0.638884589 0.701739111 0.754619541 0.761181485 0.767391543 0.771002730 0.777789735 0.781033845 0.782092391 0.790863282 0.792590534 0.798080153 0.810083607 0.813131118 0.823665343 0.826139440 0.843429442 0.850185289 0.854839204 0.877901702 0.882652760 0.902197808 0.904799387 0.917651539 0.918949797 0.921056833 0.926823801 0.933186056 1.061816126 1.156333335 1.322561083 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:-4.5486,-3.3567,2.6981;-5.0568,-3.5315,3.661;-4.0601,-4.3018,2.4063;-5.3161,-3.1258,1.9368;-3.525,-2.229,2.8098;-2.928,-2.1754,1.8817;-2.8098,-2.4671,3.6191;-4.1345,-.8461,3.0593;-4.7556,-.554,2.1926;-3.3214,-.1008,3.1274;-5.0054,-.7412,4.3245;-5.9077,-1.366,4.23;-5.3288,.3075,4.4455;-4.256,-1.1716,5.5557;-2.2107,-.8343,7.0158;-1.7922,-1.696,6.4648;-2.5197,-1.2462,7.9957;-1.1323,.2328,7.2117;-1.5952,1.1451,7.6312;-.725,.5256,6.2248;.0138,-.1968,8.1292;-.3913,-.4148,9.1366;.7052,.6574,8.2551;.8089,-1.4072,7.6367;1.1481,-1.2202,6.6;.1505,-2.2931,7.5896;2.0127,-1.7265,8.5195;1.6983,-1.9405,9.5566;2.5633,-2.6075,8.1475;2.719,-.8777,8.554;-4.4813,-2.3609,6.0134;-4.6174,-2.2162,7.1143;-3.4128,-.3089,6.2556;-3.3206,.6988,5.8322;-3.9802,3.2748,9.1829;-4.6464,3.2527,10.0634;-4.0178,4.2917,8.7569;-2.9499,3.0969,9.5395;-4.3895,2.226,8.152;-5.41,2.4446,7.7856;-3.7244,2.3025,7.2748;-4.3472,.8089,8.7141;-4.9952,.7542,9.6114;-3.3369,.5409,9.0686;-4.8692,-.2863,7.8092;-4.8196,-1.4874,8.2173;-5.7385,.0267,7.1876; -739.264437594138 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000248195654 0.000045051454 0.035973079971 0.008339319073 0.000300000000 0.000200000000 0.001813085736 0.001208723824 -0.085163834 -0.000004655 0.000051772 0.000229188 0.000316613 0.000507407 0.000616498 0.000842459 0.001062138 0.001285127 0.001538697 0.001854856 0.002860669 0.002956711 0.003841166 0.004387631 0.004657884 0.005071369 0.007025724 0.007971830 0.009356185 0.010085814 0.011236756 0.013130695 0.017087136 0.020536393 0.020843483 0.022923031 0.024846884 0.029061472 0.029738924 0.032419687 0.035344704 0.038771115 0.039459510 0.040042785 0.040392667 0.042917180 0.045462272 0.049836675 0.050360096 0.050794497 0.051981752 0.052972478 0.053316201 0.054109845 0.055832150 0.059954071 0.061993262 0.065042543 0.065588212 0.067184687 0.070360331 0.075727046 0.076414630 0.077258938 0.077916500 0.080585627 0.081663423 0.083046537 0.090427549 0.091857039 0.100439076 0.103610383 0.109082987 0.111575196 0.113283247 0.113885301 0.115689585 0.117332596 0.118730728 0.123367046 0.131723553 0.134593003 0.139715204 0.143073301 0.149336801 0.153566615 0.154727156 0.159859027 0.163921809 0.172223907 0.183843094 0.187755399 0.198329485 0.203805830 0.205367282 0.216173056 0.223036491 0.237091336 0.259354878 0.277169352 0.301720586 0.313502568 0.354359354 0.377963329 0.397845092 0.441183116 0.476309466 0.532183464 0.554449497 0.566722950 0.605179001 0.609547834 0.638885138 0.701739304 0.754620957 0.761222082 0.767395930 0.771005021 0.777792587 0.781038063 0.782092548 0.790869139 0.792593427 0.798088758 0.810087543 0.813131247 0.823668567 0.826140171 0.843431819 0.850185419 0.854840007 0.877915301 0.882651951 0.902210130 0.904800236 0.917664216 0.918965695 0.921058012 0.926823858 0.933187147 1.061821102 1.156334672 1.322561510 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:-4.5725,-3.3591,2.6992;-5.0778,-3.5262,3.6651;-4.096,-4.3104,2.4066;-5.3413,-3.1209,1.9413;-3.5355,-2.2426,2.8042;-2.9418,-2.1977,1.8734;-2.8195,-2.4871,3.6109;-4.1288,-.8522,3.0531;-4.7493,-.5548,2.1877;-3.307,-.1157,3.1173;-4.9954,-.7343,4.3204;-5.9039,-1.3509,4.2304;-5.3082,.3181,4.4381;-4.2469,-1.1672,5.5513;-2.2051,-.8315,7.0168;-1.7839,-1.6911,6.4645;-2.5165,-1.2465,7.9946;-1.1286,.2364,7.2192;-1.5935,1.1461,7.6421;-.7202,.5342,6.2342;.0168,-.1957,8.1364;-.3897,-.4204,9.1418;.7059,.6596,8.2685;.8159,-1.4012,7.6383;1.157,-1.207,6.6035;.1597,-2.2885,7.5843;2.0185,-1.723,8.5219;1.7021,-1.9445,9.5569;2.5723,-2.6001,8.1454;2.7225,-.8725,8.5636;-4.4718,-2.3578,6.0056;-4.6112,-2.2154,7.1069;-3.4056,-.3054,6.2546;-3.3134,.7034,5.834;-3.9901,3.2727,9.1876;-4.6624,3.2481,10.0634;-4.0266,4.2901,8.7628;-2.962,3.0963,9.5513;-4.3902,2.2245,8.1524;-5.4086,2.4415,7.7796;-3.7194,2.3039,7.2798;-4.3486,.8067,8.7126;-4.9998,.7501,9.6074;-3.3393,.539,9.0703;-4.8664,-.2876,7.8043;-4.8164,-1.4894,8.2103;-5.7346,.0254,7.181; -739.264438389307 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000184798861 0.000036150817 0.011362774880 0.003208074209 0.000300000000 0.000200000000 0.002435079949 0.001623386632 -0.085164038 0.000016266 0.000071001 0.000207286 0.000316217 0.000504842 0.000595088 0.000818100 0.001062381 0.001286091 0.001538578 0.001853038 0.002861034 0.002957099 0.003838359 0.004389422 0.004657811 0.005071118 0.007026772 0.007970119 0.009355983 0.010084612 0.011236783 0.013130063 0.017086550 0.020536242 0.020843292 0.022922935 0.024846811 0.029061563 0.029738904 0.032419448 0.035344683 0.038771253 0.039459556 0.040043043 0.040393909 0.042917176 0.045462179 0.049836659 0.050359319 0.050794473 0.051981588 0.052971348 0.053315824 0.054109706 0.055816148 0.059953272 0.061992174 0.065039732 0.065587502 0.067184459 0.070358212 0.075726861 0.076413991 0.077261035 0.077916354 0.080585554 0.081662667 0.083047994 0.090427562 0.091857219 0.100439988 0.103610658 0.109082930 0.111575088 0.113283513 0.113883975 0.115689607 0.117332708 0.118731590 0.123366613 0.131722950 0.134592915 0.139715279 0.143074207 0.149336961 0.153567260 0.154727729 0.159857935 0.163918675 0.172219813 0.183842516 0.187755394 0.198328711 0.203806478 0.205368448 0.216163972 0.223026057 0.237088767 0.259355887 0.277166154 0.301720850 0.313499471 0.354363120 0.377963607 0.397842324 0.441184720 0.476314959 0.532183155 0.554449519 0.566722443 0.605179475 0.609547669 0.638886137 0.701739061 0.754621184 0.761224017 0.767395064 0.771005120 0.777791302 0.781038511 0.782093015 0.790868724 0.792593308 0.798088273 0.810086603 0.813131631 0.823668348 0.826140270 0.843432058 0.850185456 0.854840084 0.877915651 0.882643910 0.902209998 0.904800156 0.917662423 0.918977688 0.921054921 0.926821105 0.933187108 1.061820610 1.156334602 1.322562380 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:-4.581,-3.3588,2.6968;-5.0845,-3.5251,3.6638;-4.1074,-4.3109,2.4029;-5.3507,-3.1184,1.9407;-3.5413,-2.2448,2.8;-2.9498,-2.2009,1.8678;-2.8241,-2.4914,3.605;-4.1307,-.8534,3.0507;-4.7525,-.5545,2.1868;-3.3073,-.1189,3.1131;-4.9941,-.7334,4.32;-5.904,-1.3483,4.2323;-5.3046,.3196,4.4378;-4.2439,-1.1669,5.5496;-2.2018,-.8307,7.0148;-1.7801,-1.6897,6.4621;-2.5129,-1.2465,7.9924;-1.126,.2378,7.2178;-1.592,1.1478,7.6389;-.7161,.5348,6.2332;.0178,-.1929,8.1376;-.3905,-.416,9.1426;.7069,.6624,8.2695;.8175,-1.3994,7.643;1.161,-1.2069,6.6086;.1611,-2.2864,7.5887;2.018,-1.7206,8.5297;1.6992,-1.9404,9.5643;2.5722,-2.5985,8.1558;2.7223,-.8704,8.5717;-4.4674,-2.358,6.0032;-4.6069,-2.2164,7.1049;-3.4027,-.305,6.2531;-3.3116,.7042,5.8332;-3.9905,3.2708,9.1886;-4.6624,3.2448,10.0648;-4.0285,4.2884,8.7644;-2.9621,3.0953,9.5516;-4.39,2.2229,8.1529;-5.409,2.4389,7.7809;-3.7199,2.3037,7.2799;-4.3463,.8047,8.712;-4.9969,.7466,9.6071;-3.3365,.5379,9.0689;-4.8634,-.2894,7.8031;-4.8121,-1.4915,8.2084;-5.732,.0231,7.1802; -739.264438543209 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 -861.13628678 14.47361492 24.78686889 38.54420290 52.14951874 68.08411158 80.62789081 84.51925715 91.57415607 103.67973460 116.78213334 149.88029649 176.50677938 193.07003832 201.77875772 230.15565887 251.04383799 255.16068896 269.34431149 278.07839238 288.37874181 300.48877672 322.64359491 348.82739020 370.36496385 438.18601591 456.01443342 468.20576452 520.62999098 540.84105919 557.21937198 610.93145744 694.80511128 750.61304674 754.30017685 759.97996536 781.43693850 810.92057670 848.83919466 869.30206080 871.97031223 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