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:-4.1003,-1.8096,2.7715;-3.1084,-1.392,3.019;-4.5885,-1.1006,2.0816;-3.9372,-2.7545,2.2223;-4.9568,-2.0339,4.0162;-5.9782,-2.316,3.7043;-5.0652,-1.0803,4.562;-4.4441,-3.1322,4.9546;-4.4635,-4.0932,4.4094;-5.1382,-3.2479,5.8058;-3.0174,-2.9523,5.5057;-2.3165,-2.731,4.6831;-2.6978,-3.8991,5.9694;-2.8757,-1.8922,6.5626;-1.8397,.3801,7.0163;-1.8921,.1867,8.0976;-2.1431,1.43,6.8715;-.4048,.2407,6.4774;.2127,1.0473,6.9156;-.4418,.4471,5.3916;.3053,-1.1022,6.699;1.0691,-1.2212,5.9097;-.4033,-1.9381,6.5471;1.0096,-1.2772,8.0495;1.8035,-.5113,8.1372;1.5309,-2.2517,8.0338;.1127,-1.218,9.2853;-.7514,-1.8974,9.1851;.6756,-1.5098,10.1887;-.2776,-.2011,9.4608;-2.9265,-2.3061,7.7907;-3.4406,-1.5428,8.3492;-2.8132,-.5213,6.2825;-2.9185,-.2806,5.2167;-4.9274,3.7789,7.5885;-4.322,4.1204,6.7292;-4.7535,4.4819,8.421;-5.9908,3.8599,7.2989;-4.5696,2.3509,7.9901;-3.5128,2.3013,8.2982;-5.1481,2.0458,8.8774;-4.8395,1.3485,6.8706;-4.3091,1.6373,5.9448;-5.9159,1.3848,6.6126;-4.5539,-.1092,7.2524;-4.2999,-.4046,8.4624;-5.1939,-.8146,6.6763; -739.257715986450 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.006229641780 0.000958140341 0.035579585934 0.008421603282 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.122975681 0.000089689 0.000152822 0.000237219 0.000346794 0.000425907 0.000512270 0.000882491 0.000947333 0.001397002 0.001658285 0.002684676 0.002935878 0.003460070 0.003761523 0.004822018 0.005163420 0.006455925 0.007287645 0.007744907 0.008845251 0.009606833 0.011660514 0.014470831 0.015551028 0.018188410 0.020699752 0.020882842 0.023094028 0.028082719 0.032314701 0.033155385 0.037343409 0.038991077 0.043103430 0.045237252 0.047087678 0.049332172 0.050293526 0.050572537 0.051203950 0.052697687 0.054302556 0.054680825 0.055004385 0.055579696 0.056419377 0.059796897 0.061700610 0.063205828 0.067670820 0.068325214 0.071211515 0.072314943 0.074349480 0.076739497 0.077380935 0.079876738 0.082615609 0.087583251 0.089200537 0.094071280 0.099159546 0.103811330 0.105173587 0.107164998 0.110260039 0.113675699 0.114431068 0.114804182 0.117453763 0.122783172 0.126735872 0.132958810 0.138238386 0.146921043 0.151555689 0.153572742 0.158557453 0.166267032 0.171139125 0.174205734 0.177608442 0.182114776 0.189845820 0.206833966 0.210073266 0.213276326 0.224435516 0.239810121 0.256299508 0.268778892 0.295810658 0.310403837 0.356617473 0.365881996 0.384434459 0.434238339 0.459926606 0.508098824 0.541668095 0.561702692 0.599912754 0.635126069 0.655946286 0.695776401 0.749876610 0.757446925 0.762348491 0.768080111 0.771395931 0.776788653 0.785822819 0.790829746 0.795142183 0.800390446 0.808639443 0.810482023 0.823461738 0.836461578 0.840293447 0.848769964 0.857958191 0.869316621 0.880244923 0.888766595 0.894500287 0.917324855 0.921199060 0.921741062 0.924826148 0.938066251 1.032634446 1.072237028 1.264201243 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:-4.1021,-1.8111,2.7724;-3.1097,-1.3954,3.0209;-4.5886,-1.1012,2.0822;-3.9397,-2.756,2.223;-4.9601,-2.0345,4.0164;-5.9826,-2.3114,3.7034;-5.0632,-1.0807,4.5633;-4.4512,-3.1354,4.954;-4.4737,-4.0958,4.4077;-5.1464,-3.25,5.8048;-3.0252,-2.958,5.5046;-2.3234,-2.7483,4.6796;-2.7098,-3.9025,5.9759;-2.8717,-1.8911,6.5554;-1.8334,.3816,7.008;-1.8913,.1834,8.0882;-2.1408,1.4308,6.864;-.3927,.2496,6.4804;.2216,1.0547,6.926;-.4237,.4598,5.3952;.3129,-1.0959,6.7007;1.0769,-1.2172,5.912;-.4,-1.9276,6.5473;1.0139,-1.2755,8.0521;1.8094,-.5116,8.1434;1.5327,-2.2514,8.0353;.1136,-1.2174,9.2855;-.7511,-1.8954,9.1811;.6739,-1.5108,10.1901;-.2761,-.2003,9.4611;-2.9255,-2.2936,7.7886;-3.4699,-1.518,8.338;-2.7836,-.5284,6.2597;-2.8829,-.289,5.1932;-4.927,3.7781,7.5898;-4.3209,4.1148,6.7291;-4.7506,4.4836,8.4195;-5.9902,3.8617,7.3004;-4.5736,2.3503,7.9973;-3.5157,2.2977,8.3013;-5.1514,2.0538,8.8883;-4.8505,1.3442,6.8825;-4.3133,1.6211,5.9574;-5.9251,1.3891,6.6177;-4.578,-.1103,7.2612;-4.2983,-.4174,8.4592;-5.1991,-.8237,6.6786; -739.258214761413 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.002798250921 0.000551403532 0.028610310023 0.008421909458 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124436809 0.000080314 0.000152954 0.000237827 0.000347467 0.000428846 0.000525619 0.000888574 0.000955340 0.001422662 0.001746335 0.002746037 0.002945914 0.003545994 0.003908015 0.005066154 0.005199789 0.006636394 0.007315032 0.007795252 0.009087439 0.009821844 0.012021045 0.014479857 0.016071802 0.018382034 0.020816740 0.021424313 0.025860109 0.028602061 0.032315975 0.033157130 0.037368834 0.039144655 0.043109856 0.045243938 0.047106978 0.049331532 0.050295565 0.050572501 0.051215884 0.052697734 0.054308714 0.054681378 0.055004625 0.055580895 0.056415811 0.059799354 0.061730698 0.063210189 0.067672600 0.068363916 0.071210791 0.072419428 0.074354620 0.076738990 0.077454196 0.079882389 0.082671429 0.087592613 0.089199159 0.094072913 0.099181997 0.103830956 0.105174402 0.107226916 0.110372248 0.113679220 0.114496965 0.114821663 0.117505365 0.122895273 0.127087608 0.132958656 0.138238243 0.147177338 0.151579027 0.153579076 0.158689896 0.166283730 0.171163304 0.174211074 0.177623829 0.182117410 0.189958213 0.206915942 0.210228212 0.213284018 0.224727050 0.239830975 0.256419170 0.268779800 0.296456685 0.310583061 0.356821175 0.365987861 0.385239144 0.434581786 0.459970759 0.508244481 0.541682179 0.561705070 0.599943780 0.635125941 0.655953564 0.695788042 0.749877342 0.757447363 0.762413161 0.768081563 0.771396066 0.776788674 0.785866529 0.790831099 0.795155289 0.800401276 0.808640166 0.810482363 0.823462188 0.836495601 0.840301151 0.848769858 0.857992976 0.869338701 0.880244621 0.888766595 0.894507307 0.917325734 0.921198923 0.921747851 0.924828004 0.938105755 1.032665068 1.072250418 1.264301999 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:-4.1065,-1.8161,2.7721;-3.1115,-1.4065,3.0203;-4.5883,-1.1038,2.0811;-3.9501,-2.7628,2.2241;-4.9656,-2.0318,4.0166;-5.9902,-2.3022,3.7047;-5.0617,-1.0763,4.5618;-4.4629,-3.1337,4.9561;-4.4921,-4.0953,4.4117;-5.1585,-3.2431,5.8073;-3.0341,-2.9652,5.505;-2.3315,-2.77,4.6771;-2.7296,-3.9098,5.9835;-2.8715,-1.8934,6.5509;-1.8274,.3825,6.9977;-1.8913,.1851,8.0776;-2.1384,1.4305,6.8504;-.3799,.26,6.485;.2254,1.0631,6.9478;-.3951,.4821,5.4017;.3271,-1.0853,6.7027;1.0954,-1.2033,5.9175;-.3855,-1.916,6.5423;1.0209,-1.2712,8.0571;1.8185,-.5102,8.1557;1.5369,-2.2487,8.0398;.1135,-1.2147,9.2852;-.7527,-1.8897,9.173;.6672,-1.5125,10.1925;-.2746,-.1969,9.4613;-2.9316,-2.2878,7.7833;-3.4885,-1.5063,8.3281;-2.7774,-.5291,6.2499;-2.8629,-.2971,5.1798;-4.9231,3.7725,7.5927;-4.3168,4.1029,6.7298;-4.7408,4.4797,8.4199;-5.9864,3.8618,7.3052;-4.5769,2.3433,8.0024;-3.5194,2.2856,8.3064;-5.1562,2.0515,8.8941;-4.8585,1.3397,6.8858;-4.3275,1.6205,5.9594;-5.9346,1.3826,6.6284;-4.5736,-.1145,7.2509;-4.2944,-.4233,8.4506;-5.1947,-.8277,6.6692; -739.258416703926 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001059343241 0.000269930761 0.025262018810 0.008421810524 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124658012 0.000088408 0.000152497 0.000235734 0.000309189 0.000400646 0.000486790 0.000906339 0.000933370 0.001403664 0.001686808 0.002729277 0.002953800 0.003552241 0.004004979 0.005099675 0.005301065 0.006747873 0.007315644 0.007821176 0.009069244 0.009830497 0.012121809 0.014487283 0.016131845 0.018390264 0.020817515 0.021483104 0.025798890 0.028592998 0.032316063 0.033157051 0.037373891 0.039150949 0.043109855 0.045243453 0.047101312 0.049332887 0.050296211 0.050574703 0.051215829 0.052697846 0.054308484 0.054683246 0.055004573 0.055581987 0.056414950 0.059802230 0.061743743 0.063244289 0.067674173 0.068377106 0.071211753 0.072436645 0.074357800 0.076741273 0.077460914 0.079885449 0.082672069 0.087593445 0.089204132 0.094072886 0.099181493 0.103830485 0.105174314 0.107228136 0.110369173 0.113679117 0.114495084 0.114822438 0.117503611 0.122909671 0.127086718 0.132958546 0.138238085 0.147196538 0.151578459 0.153580968 0.158697707 0.166286684 0.171161953 0.174213054 0.177623235 0.182123720 0.189974933 0.206926215 0.210250726 0.213284831 0.224724008 0.239831069 0.256489758 0.268837505 0.296682124 0.310627903 0.356879445 0.366083657 0.385271769 0.434679360 0.459995233 0.508252749 0.541682651 0.561716691 0.599943377 0.635131186 0.655967233 0.695787842 0.749880692 0.757450051 0.762433442 0.768083626 0.771396140 0.776791367 0.785866930 0.790832724 0.795155299 0.800401771 0.808640277 0.810482790 0.823465264 0.836503493 0.840301246 0.848775198 0.858001998 0.869339665 0.880247798 0.888767629 0.894510302 0.917325957 0.921205916 0.921748943 0.924828175 0.938119433 1.032753958 1.072298426 1.264312499 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:-4.1125,-1.8238,2.769;-3.1127,-1.4237,3.0137;-4.5882,-1.1094,2.0759;-3.9673,-2.7746,2.225;-4.9711,-2.0248,4.0164;-5.999,-2.2873,3.7082;-5.0569,-1.0653,4.5563;-4.4765,-3.1264,4.9606;-4.5174,-4.0906,4.4213;-5.171,-3.2246,5.8142;-3.0442,-2.9701,5.5045;-2.3417,-2.7869,4.6738;-2.7493,-3.9158,5.9865;-2.8661,-1.8965,6.5473;-1.8246,.3835,6.9931;-1.8935,.1875,8.0729;-2.14,1.4298,6.8424;-.3723,.2705,6.4914;.2244,1.0729,6.9663;-.3781,.5015,5.4099;.3395,-1.073,6.7051;1.1136,-1.1826,5.9244;-.369,-1.9054,6.5346;1.0254,-1.2644,8.063;1.8233,-.5047,8.1691;1.5405,-2.2423,8.0453;.1105,-1.2108,9.2857;-.7565,-1.8832,9.1652;.6577,-1.5133,10.1954;-.2761,-.1926,9.463;-2.9221,-2.2881,7.7795;-3.4904,-1.504,8.324;-2.7683,-.5334,6.2423;-2.8509,-.3039,5.1714;-4.9165,3.7649,7.5956;-4.3093,4.0925,6.7322;-4.729,4.4702,8.4231;-5.9796,3.8604,7.3095;-4.5772,2.3335,8.003;-3.5208,2.2706,8.3095;-5.1599,2.0422,8.8927;-4.8599,1.3338,6.8832;-4.3328,1.6197,5.9557;-5.9376,1.3749,6.6302;-4.5711,-.1211,7.2422;-4.2932,-.431,8.4428;-5.1898,-.8352,6.6589; -739.258522968208 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000914364131 0.000172291832 0.025511042061 0.008421982053 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124572211 0.000130021 0.000155365 0.000237353 0.000352280 0.000435834 0.000510939 0.000911056 0.000982551 0.001434852 0.001726444 0.002732693 0.002951799 0.003542334 0.004012744 0.005089236 0.005267580 0.006731832 0.007316922 0.007812563 0.009070258 0.009826115 0.012116421 0.014488172 0.016132447 0.018389473 0.020820659 0.021491229 0.025787958 0.028592268 0.032316057 0.033157018 0.037375178 0.039151486 0.043109812 0.045243375 0.047103961 0.049333875 0.050296514 0.050575701 0.051215835 0.052697788 0.054308308 0.054684375 0.055004746 0.055581704 0.056415302 0.059802118 0.061743265 0.063254305 0.067676633 0.068375609 0.071211166 0.072435073 0.074359913 0.076741330 0.077462816 0.079885669 0.082671633 0.087593734 0.089207955 0.094073605 0.099182011 0.103835589 0.105174292 0.107229881 0.110375697 0.113680319 0.114498839 0.114824273 0.117506766 0.122910834 0.127099190 0.132959825 0.138237818 0.147198129 0.151578753 0.153580879 0.158699453 0.166288578 0.171162250 0.174214344 0.177624129 0.182122650 0.189977204 0.206930644 0.210250409 0.213299131 0.224724955 0.239831517 0.256486304 0.268854281 0.296686399 0.310630051 0.356883842 0.366087157 0.385271960 0.434679200 0.459996298 0.508256506 0.541684929 0.561719643 0.599945275 0.635132449 0.655969260 0.695787975 0.749897910 0.757450913 0.762433381 0.768089249 0.771396053 0.776794144 0.785869941 0.790834089 0.795160984 0.800402543 0.808640268 0.810483178 0.823467276 0.836506894 0.840301251 0.848778131 0.858006243 0.869342985 0.880247672 0.888768423 0.894510423 0.917325926 0.921205782 0.921753791 0.924829842 0.938128067 1.032854763 1.072300909 1.264340616 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:-4.1192,-1.8338,2.7627;-3.1132,-1.445,3.0003;-4.5889,-1.1179,2.0671;-3.9888,-2.7901,2.2242;-4.9747,-2.0155,4.0153;-6.0072,-2.2677,3.7136;-5.0464,-1.051,4.5485;-4.4889,-3.1166,4.9649;-4.5429,-4.0836,4.4317;-5.1819,-3.202,5.8213;-3.053,-2.9731,5.5035;-2.3518,-2.7991,4.6699;-2.766,-3.9205,5.9868;-2.8621,-1.8992,6.544;-1.8219,.3835,6.9892;-1.8943,.1878,8.0688;-2.1414,1.4283,6.8366;-.3664,.2791,6.4954;.2229,1.0827,6.9771;-.3667,.5145,5.415;.3509,-1.0614,6.7083;1.1308,-1.1637,5.9323;-.3525,-1.8964,6.5298;1.0291,-1.2547,8.0698;1.8245,-.4934,8.183;1.5468,-2.2313,8.0524;.1066,-1.2068,9.2869;-.759,-1.8795,9.1579;.6481,-1.5124,10.199;-.2821,-.1897,9.4658;-2.9159,-2.2886,7.7772;-3.4899,-1.5041,8.3208;-2.7587,-.5373,6.2359;-2.8429,-.308,5.1651;-4.909,3.7569,7.5986;-4.2991,4.0832,6.7367;-4.7193,4.4596,8.4277;-5.9713,3.8578,7.3113;-4.5766,2.3234,8.0039;-3.5212,2.2554,8.3128;-5.1626,2.0326,8.8918;-4.8603,1.3265,6.8817;-4.3345,1.6145,5.9542;-5.9383,1.3673,6.63;-4.5707,-.128,7.2375;-4.2919,-.4399,8.4373;-5.1854,-.843,6.6519; -739.258587497889 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000386581566 0.000095366398 0.026819908230 0.008422656260 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124609163 0.000114975 0.000155624 0.000230868 0.000374338 0.000449162 0.000553414 0.000910569 0.000980845 0.001435581 0.001682857 0.002738412 0.002951573 0.003545365 0.004018491 0.005087582 0.005270371 0.006731939 0.007316892 0.007813806 0.009072826 0.009826929 0.012126464 0.014488056 0.016135279 0.018390141 0.020820030 0.021491457 0.025798789 0.028595720 0.032316029 0.033157050 0.037374793 0.039151359 0.043109791 0.045243390 0.047104358 0.049333874 0.050296472 0.050575762 0.051215751 0.052697783 0.054308033 0.054684292 0.055004691 0.055581452 0.056414705 0.059802266 0.061744317 0.063253799 0.067676291 0.068375250 0.071210350 0.072434534 0.074360102 0.076740604 0.077462508 0.079886591 0.082671447 0.087593763 0.089207393 0.094073573 0.099182333 0.103838471 0.105174218 0.107229695 0.110377893 0.113680110 0.114499115 0.114824127 0.117507905 0.122912465 0.127102770 0.132959479 0.138237653 0.147200609 0.151578841 0.153580843 0.158701491 0.166288322 0.171162185 0.174214170 0.177623794 0.182122524 0.189979156 0.206930027 0.210254369 0.213297689 0.224723308 0.239831350 0.256489798 0.268855891 0.296685425 0.310631046 0.356884580 0.366086935 0.385271478 0.434679188 0.459995905 0.508256301 0.541684790 0.561719561 0.599945604 0.635132912 0.655969209 0.695788904 0.749898601 0.757450940 0.762435252 0.768088963 0.771396821 0.776796262 0.785870457 0.790834393 0.795160748 0.800403581 0.808640253 0.810483231 0.823467537 0.836506726 0.840301595 0.848779393 0.858006027 0.869343034 0.880248734 0.888768348 0.894510604 0.917325935 0.921208697 0.921753352 0.924830235 0.938128024 1.032855954 1.072302011 1.264340033 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:-4.1295,-1.8453,2.7544;-3.1167,-1.4683,2.9826;-4.5945,-1.1278,2.0573;-4.0156,-2.8069,2.2214;-4.9782,-2.0077,4.0142;-6.016,-2.2493,3.7215;-5.0343,-1.0386,4.5412;-4.4985,-3.1082,4.9675;-4.5638,-4.0771,4.4393;-5.1887,-3.1835,5.827;-3.0591,-2.9747,5.4999;-2.3603,-2.806,4.6634;-2.777,-3.9239,5.9824;-2.8582,-1.9021,6.54;-1.8208,.3831,6.9863;-1.8953,.1878,8.0657;-2.1438,1.4266,6.8322;-.3633,.2858,6.4975;.2196,1.0922,6.9824;-.3602,.5221,5.4174;.3609,-1.0506,6.7128;1.1471,-1.1459,5.9422;-.336,-1.8896,6.5274;1.0311,-1.2425,8.0785;1.8215,-.477,8.1985;1.5545,-2.216,8.0627;.1004,-1.2021,9.2898;-.7623,-1.8769,9.1526;.6368,-1.5093,10.2043;-.2927,-.1869,9.47;-2.9083,-2.2916,7.773;-3.4873,-1.5076,8.3172;-2.7544,-.5403,6.2321;-2.8399,-.3105,5.1614;-4.8981,3.7495,7.6022;-4.2832,4.0745,6.7433;-4.7079,4.4495,8.4336;-5.9588,3.8564,7.3111;-4.5743,2.3137,8.0058;-3.5205,2.2398,8.3186;-5.1651,2.0236,8.8907;-4.8582,1.3203,6.8806;-4.3326,1.6107,5.9537;-5.9361,1.3614,6.6289;-4.5677,-.1348,7.2326;-4.2902,-.4484,8.4328;-5.1818,-.8485,6.6455; -739.258626584359 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000425341397 0.000100289146 0.027646463129 0.008418347462 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124609095 0.000130263 0.000160657 0.000235027 0.000374495 0.000448369 0.000533879 0.000914268 0.000981672 0.001423118 0.001681135 0.002738215 0.002951456 0.003544922 0.004017354 0.005088854 0.005270331 0.006732325 0.007317120 0.007813808 0.009073760 0.009827539 0.012128030 0.014488000 0.016135452 0.018389949 0.020821255 0.021491783 0.025801065 0.028596724 0.032316003 0.033157046 0.037374614 0.039151237 0.043109867 0.045243308 0.047104550 0.049333903 0.050296516 0.050575628 0.051215672 0.052697623 0.054307894 0.054684205 0.055004702 0.055581085 0.056414133 0.059801423 0.061743540 0.063253898 0.067676153 0.068375068 0.071209883 0.072433857 0.074360265 0.076739125 0.077462044 0.079886412 0.082671284 0.087594048 0.089207393 0.094073556 0.099182969 0.103838756 0.105174101 0.107230085 0.110378168 0.113680177 0.114499187 0.114823899 0.117508089 0.122912601 0.127102958 0.132959338 0.138237388 0.147200975 0.151578928 0.153580862 0.158701732 0.166286915 0.171162356 0.174214464 0.177623337 0.182122377 0.189979251 0.206929366 0.210251096 0.213293488 0.224721570 0.239828937 0.256484483 0.268856574 0.296684554 0.310630803 0.356886330 0.366087034 0.385271412 0.434679237 0.459995654 0.508256248 0.541684887 0.561719685 0.599945666 0.635133214 0.655969170 0.695788984 0.749898491 0.757451095 0.762435794 0.768088763 0.771396244 0.776796036 0.785871149 0.790834445 0.795161134 0.800403455 0.808640247 0.810483229 0.823467557 0.836506639 0.840301642 0.848779425 0.858006380 0.869343115 0.880247811 0.888768204 0.894510460 0.917326051 0.921208112 0.921752709 0.924829933 0.938127897 1.032857616 1.072302309 1.264340252 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:-4.1426,-1.8571,2.7444;-3.1242,-1.4896,2.9627;-4.6052,-1.139,2.0464;-4.0432,-2.8229,2.2165;-4.9832,-2.0029,4.0115;-6.0253,-2.2363,3.7283;-5.0259,-1.03,4.5324;-4.5065,-3.1018,4.9682;-4.5813,-4.0727,4.4451;-5.1932,-3.1683,5.8313;-3.0638,-2.9752,5.4936;-2.3681,-2.8092,4.654;-2.7839,-3.9257,5.9746;-2.8546,-1.9041,6.534;-1.8192,.383,6.9825;-1.8957,.1878,8.0618;-2.1442,1.4257,6.8273;-.3601,.29,6.4979;.2179,1.1004,6.9817;-.3551,.5229,5.417;.3693,-1.0422,6.7197;1.1608,-1.1341,5.9543;-.3219,-1.885,6.531;1.0323,-1.2287,8.0897;1.8164,-.4574,8.2143;1.5629,-2.1984,8.0774;.0941,-1.1948,9.2954;-.7641,-1.874,9.152;.6267,-1.5005,10.2126;-.3056,-.182,9.4748;-2.902,-2.2943,7.7667;-3.485,-1.5113,8.3117;-2.7494,-.5422,6.2264;-2.8362,-.3113,5.156;-4.8857,3.7431,7.6083;-4.2643,4.0673,6.7538;-4.6965,4.4396,8.4427;-5.9442,3.8562,7.3116;-4.5712,2.3045,8.0095;-3.5192,2.2243,8.3266;-5.1672,2.0153,8.8913;-4.8554,1.3154,6.8806;-4.3294,1.6087,5.9549;-5.9332,1.3576,6.6286;-4.5654,-.1406,7.2282;-4.288,-.4576,8.4275;-5.1784,-.8532,6.6387; -739.258650133476 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000222129316 0.000065253609 0.032506641436 0.008422576900 0.000300000000 0.000200000000 0.002025846963 0.001350564642 -0.124609728 0.000116411 0.000158744 0.000242514 0.000374443 0.000445167 0.000535008 0.000913236 0.000975522 0.001425812 0.001682134 0.002738394 0.002951444 0.003545121 0.004017367 0.005088794 0.005271301 0.006732322 0.007317257 0.007814321 0.009074045 0.009827821 0.012128430 0.014487953 0.016135547 0.018389831 0.020821350 0.021492070 0.025802237 0.028597414 0.032315942 0.033157068 0.037374515 0.039151179 0.043109873 0.045243342 0.047104931 0.049333901 0.050296510 0.050575355 0.051215547 0.052697489 0.054307919 0.054684095 0.055004470 0.055580711 0.056413273 0.059800301 0.061743006 0.063253869 0.067676038 0.068375088 0.071208730 0.072433075 0.074360281 0.076737887 0.077461465 0.079886287 0.082671322 0.087593955 0.089207868 0.094073626 0.099182701 0.103839070 0.105173966 0.107229439 0.110378465 0.113679827 0.114499314 0.114823645 0.117508214 0.122912847 0.127103356 0.132959185 0.138237165 0.147200891 0.151579268 0.153580943 0.158702198 0.166285506 0.171161959 0.174213836 0.177623934 0.182122107 0.189979326 0.206928563 0.210246764 0.213287811 0.224719622 0.239826531 0.256479173 0.268855954 0.296683844 0.310630044 0.356884486 0.366087006 0.385271260 0.434679257 0.459995483 0.508255906 0.541684851 0.561719646 0.599945313 0.635133294 0.655969176 0.695788848 0.749898063 0.757450667 0.762435891 0.768088698 0.771395108 0.776795690 0.785871268 0.790834451 0.795160950 0.800403234 0.808640218 0.810483044 0.823467494 0.836506446 0.840301462 0.848777732 0.858006045 0.869343158 0.880245230 0.888767702 0.894510209 0.917325613 0.921207355 0.921751887 0.924829237 0.938127843 1.032857807 1.072301931 1.264339700 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:-4.1614,-1.8695,2.7326;-3.1377,-1.5094,2.9384;-4.6259,-1.1506,2.0367;-4.0758,-2.8382,2.2076;-4.9892,-2.0035,4.0094;-6.0357,-2.2321,3.7384;-5.0205,-1.0277,4.5257;-4.5084,-3.1,4.9665;-4.5878,-4.0721,4.4467;-5.1898,-3.1633,5.8339;-3.0626,-2.9731,5.4834;-2.372,-2.8041,4.6404;-2.7787,-3.9241,5.9607;-2.8503,-1.9044,6.5256;-1.8177,.3837,6.9784;-1.8972,.189,8.0576;-2.1431,1.426,6.8217;-.357,.2921,6.4986;.2177,1.1058,6.9814;-.3487,.5207,5.4167;.3749,-1.0374,6.7286;1.1711,-1.1289,5.9679;-.3126,-1.8829,6.5383;1.0309,-1.2178,8.1029;1.811,-.4429,8.23;1.5658,-2.1852,8.0958;.0861,-1.1855,9.3035;-.7693,-1.8673,9.1562;.6148,-1.4887,10.2239;-.3175,-.1738,9.4798;-2.896,-2.2972,7.7574;-3.4816,-1.5162,8.3042;-2.7462,-.5419,6.2206;-2.8337,-.309,5.1507;-4.8734,3.7391,7.616;-4.2475,4.0633,6.7648;-4.6841,4.4323,8.4534;-5.9302,3.8577,7.3159;-4.5663,2.2981,8.0137;-3.5155,2.2123,8.3332;-5.1656,2.0088,8.8931;-4.8519,1.3134,6.8813;-4.3263,1.6097,5.9563;-5.9298,1.3571,6.63;-4.5622,-.144,7.2234;-4.2855,-.4648,8.4222;-5.1755,-.8542,6.6317; -739.258661549060 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000446933882 0.000088438538 0.027993801908 0.008418524891 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124609373 0.000087937 0.000159483 0.000237593 0.000375011 0.000445620 0.000532699 0.000913463 0.000978778 0.001425630 0.001684271 0.002738392 0.002951449 0.003545216 0.004017360 0.005088969 0.005270781 0.006732328 0.007317596 0.007814072 0.009074687 0.009828167 0.012129092 0.014488055 0.016135586 0.018389934 0.020821988 0.021492135 0.025802972 0.028597594 0.032315948 0.033157103 0.037374522 0.039151250 0.043109889 0.045243334 0.047105514 0.049334059 0.050296513 0.050575150 0.051215403 0.052697492 0.054308156 0.054684042 0.055004214 0.055580139 0.056412872 0.059798908 0.061742735 0.063253789 0.067676008 0.068374998 0.071208130 0.072433446 0.074360345 0.076737744 0.077461355 0.079886226 0.082671581 0.087593928 0.089207634 0.094073665 0.099182688 0.103839408 0.105173854 0.107229106 0.110378645 0.113679684 0.114500086 0.114823420 0.117508436 0.122912714 0.127103341 0.132959123 0.138237088 0.147200736 0.151579252 0.153580968 0.158703170 0.166285531 0.171162120 0.174213871 0.177623848 0.182122540 0.189979422 0.206927917 0.210243928 0.213285563 0.224717887 0.239825580 0.256476035 0.268855877 0.296683720 0.310629969 0.356884244 0.366087111 0.385271382 0.434679244 0.459995389 0.508255806 0.541684756 0.561719674 0.599945275 0.635133311 0.655969150 0.695789046 0.749897452 0.757450832 0.762436068 0.768088715 0.771394860 0.776795505 0.785871334 0.790834444 0.795160731 0.800403156 0.808640211 0.810482830 0.823467498 0.836506400 0.840301325 0.848776366 0.858005902 0.869343118 0.880242238 0.888767464 0.894509931 0.917325247 0.921207106 0.921751320 0.924828802 0.938127901 1.032858054 1.072301431 1.264339373 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:-4.1813,-1.8827,2.7203;-3.155,-1.5241,2.9132;-4.6516,-1.1658,2.0262;-4.1037,-2.8536,2.1986;-4.9956,-2.0095,4.0065;-6.0452,-2.2372,3.7475;-5.0194,-1.0314,4.5186;-4.5066,-3.1027,4.9635;-4.5865,-4.0762,4.4465;-5.1827,-3.1658,5.835;-3.0584,-2.9697,5.4721;-2.3732,-2.7949,4.6257;-2.7668,-3.9205,5.9455;-2.8465,-1.9029,6.5164;-1.816,.3855,6.9747;-1.8988,.1911,8.0537;-2.1403,1.428,6.8167;-.3539,.2927,6.4996;.219,1.1088,6.9803;-.3426,.5165,5.4167;.3779,-1.0353,6.7378;1.1773,-1.1291,5.9809;-.3082,-1.8821,6.5482;1.0283,-1.2097,8.1156;1.8057,-.4324,8.2436;1.5656,-2.1757,8.1139;.0783,-1.1762,9.3121;-.7747,-1.8606,9.1629;.6037,-1.4756,10.2355;-.3285,-.165,9.4839;-2.8927,-2.2983,7.7473;-3.4801,-1.519,8.2955;-2.7428,-.5395,6.2143;-2.8305,-.3044,5.1448;-4.8621,3.738,7.6265;-4.2331,4.0635,6.7781;-4.6724,4.427,8.4671;-5.9178,3.8613,7.3243;-4.5606,2.2944,8.019;-3.5107,2.2037,8.3397;-5.1623,2.0038,8.8964;-4.8478,1.3149,6.8824;-4.3221,1.6144,5.9585;-5.9257,1.3611,6.6315;-4.56,-.1441,7.2185;-4.2838,-.4701,8.416;-5.1733,-.8515,6.6234; -739.258667986905 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000127475416 0.000045692680 0.034735011713 0.008419408216 0.000300000000 0.000200000000 0.003530092416 0.002353394944 -0.124608083 0.000103820 0.000160358 0.000247822 0.000377463 0.000444764 0.000530375 0.000914609 0.000980742 0.001426234 0.001685302 0.002739287 0.002951452 0.003545558 0.004017675 0.005089425 0.005270718 0.006732859 0.007317999 0.007814036 0.009075500 0.009828620 0.012129567 0.014488188 0.016135934 0.018390344 0.020822419 0.021493085 0.025803927 0.028598427 0.032315945 0.033157118 0.037374479 0.039151348 0.043109899 0.045243291 0.047105661 0.049333982 0.050296577 0.050574928 0.051215251 0.052697565 0.054308102 0.054684019 0.055004010 0.055579439 0.056413605 0.059798037 0.061742813 0.063253713 0.067675902 0.068374812 0.071207388 0.072433034 0.074360032 0.076737949 0.077460298 0.079886219 0.082671651 0.087593933 0.089208901 0.094073715 0.099182462 0.103839746 0.105173745 0.107228653 0.110379316 0.113679948 0.114500099 0.114823450 0.117509122 0.122912881 0.127104608 0.132959225 0.138236968 0.147201422 0.151579665 0.153580997 0.158703556 0.166285433 0.171161826 0.174213452 0.177624970 0.182122647 0.189980104 0.206927546 0.210243068 0.213286979 0.224717127 0.239824972 0.256474525 0.268854827 0.296683814 0.310630211 0.356883703 0.366087285 0.385271695 0.434679725 0.459995475 0.508256972 0.541685081 0.561722004 0.599946193 0.635133935 0.655969910 0.695790814 0.749898242 0.757450837 0.762436202 0.768088994 0.771396061 0.776795529 0.785871686 0.790834518 0.795162032 0.800403730 0.808640498 0.810483142 0.823467487 0.836506445 0.840301420 0.848776891 0.858007598 0.869343391 0.880242186 0.888767541 0.894509739 0.917325315 0.921209475 0.921751026 0.924828694 0.938128358 1.032860800 1.072301299 1.264339310 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:-4.2045,-1.8927,2.7103;-3.1735,-1.5384,2.889;-4.6812,-1.1747,2.0216;-4.1385,-2.8651,2.1891;-5.0024,-2.0138,4.0075;-6.056,-2.2404,3.7627;-5.0176,-1.034,4.5167;-4.5027,-3.1047,4.9615;-4.583,-4.079,4.4459;-5.172,-3.1696,5.8382;-3.0512,-2.9651,5.4598;-2.3727,-2.7825,4.6097;-2.7502,-3.9158,5.9277;-2.8405,-1.901,6.5071;-1.8129,.3877,6.9713;-1.9001,.1945,8.0501;-2.1357,1.4303,6.811;-.3488,.2933,6.5024;.2222,1.1104,6.984;-.3324,.5146,5.419;.3815,-1.0343,6.7473;1.185,-1.1296,5.9947;-.3036,-1.8815,6.5558;1.0248,-1.2057,8.1289;1.802,-.4284,8.259;1.5616,-2.1719,8.1323;.0689,-1.169,9.3207;-.7839,-1.8531,9.1689;.5896,-1.4669,10.2475;-.3378,-.1571,9.4884;-2.887,-2.2998,7.7367;-3.4758,-1.5223,8.2869;-2.7387,-.5366,6.2085;-2.8259,-.2995,5.1393;-4.8558,3.7363,7.6329;-4.2278,4.0636,6.7846;-4.6646,4.4229,8.4751;-5.9117,3.8612,7.3326;-4.5548,2.2916,8.0208;-3.5046,2.1996,8.3397;-5.1553,1.999,8.8982;-4.8439,1.3154,6.8819;-4.3199,1.6175,5.9579;-5.9223,1.3623,6.6332;-4.5554,-.1445,7.2131;-4.2798,-.474,8.4099;-5.1687,-.8501,6.616; -739.258670226987 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000521213495 0.000103680125 0.025499254394 0.008434761810 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124608317 0.000030517 0.000167090 0.000265342 0.000379802 0.000452992 0.000539647 0.000925635 0.000986279 0.001450615 0.001686820 0.002739099 0.002951507 0.003545650 0.004018808 0.005089635 0.005270559 0.006732757 0.007318220 0.007813983 0.009075472 0.009829126 0.012130311 0.014488415 0.016136135 0.018390193 0.020823103 0.021493436 0.025805185 0.028599401 0.032316299 0.033157154 0.037374686 0.039151393 0.043109860 0.045243325 0.047105822 0.049333960 0.050296629 0.050574734 0.051215469 0.052697568 0.054308017 0.054683736 0.055003777 0.055578342 0.056412861 0.059796615 0.061742972 0.063253704 0.067676474 0.068374872 0.071207277 0.072433113 0.074361080 0.076738790 0.077459580 0.079886251 0.082671733 0.087594036 0.089208926 0.094074034 0.099182374 0.103840394 0.105173670 0.107228741 0.110379434 0.113680009 0.114501130 0.114823351 0.117509679 0.122913063 0.127105021 0.132960393 0.138236771 0.147201086 0.151581794 0.153581854 0.158703956 0.166285600 0.171161700 0.174214917 0.177626090 0.182122831 0.189979981 0.206930665 0.210242829 0.213305989 0.224716241 0.239825340 0.256478220 0.268855060 0.296684219 0.310630340 0.356893676 0.366087902 0.385272813 0.434679873 0.459996157 0.508258277 0.541685039 0.561723514 0.599946774 0.635134136 0.655969930 0.695790760 0.749898314 0.757451415 0.762436244 0.768090406 0.771396093 0.776795873 0.785871719 0.790834635 0.795163211 0.800405180 0.808640483 0.810483107 0.823467524 0.836506429 0.840301388 0.848779786 0.858007506 0.869344385 0.880253010 0.888768579 0.894510691 0.917327321 0.921209424 0.921750642 0.924829228 0.938128464 1.032862310 1.072301706 1.264339311 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:-4.2203,-1.895,2.7068;-3.195,-1.5286,2.8819;-4.7067,-1.1842,2.0174;-4.1442,-2.8662,2.1886;-5.0114,-2.0229,4.0059;-6.0633,-2.2558,3.765;-5.031,-1.0442,4.5148;-4.5009,-3.1111,4.9575;-4.5788,-4.0858,4.4424;-5.1651,-3.1794,5.8378;-3.0478,-2.9635,5.4479;-2.3749,-2.7745,4.5946;-2.7383,-3.9137,5.9116;-2.8381,-1.901,6.4971;-1.8127,.3885,6.9643;-1.9033,.1973,8.0432;-2.1341,1.4312,6.801;-.3473,.2918,6.5005;.2218,1.1118,6.9788;-.3278,.5065,5.416;.3828,-1.034,6.7559;1.1893,-1.1334,6.0072;-.301,-1.8826,6.5669;1.0208,-1.1967,8.141;1.7961,-.4175,8.2701;1.5593,-2.1621,8.1519;.0601,-1.155,9.3288;-.7906,-1.8416,9.1772;.5777,-1.4467,10.2591;-.3494,-.143,9.4895;-2.884,-2.3023,7.726;-3.4737,-1.5264,8.2777;-2.7376,-.536,6.2007;-2.8264,-.2976,5.132;-4.8386,3.7348,7.6418;-4.2045,4.0613,6.7973;-4.6461,4.417,8.4873;-5.8929,3.8681,7.3373;-4.5486,2.2862,8.026;-3.4996,2.1859,8.3481;-5.154,1.9945,8.9007;-4.8408,1.3155,6.8831;-4.3171,1.6204,5.9599;-5.9194,1.3652,6.6354;-4.5541,-.1462,7.2084;-4.2777,-.4802,8.4038;-5.168,-.8492,6.6091; -739.258663264276 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001351700675 0.000300538564 0.041207776082 0.008409996540 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124608312 -0.000306553 0.000168675 0.000278461 0.000402909 0.000487626 0.000596083 0.000961920 0.001006169 0.001677580 0.001711790 0.002739160 0.002951666 0.003545721 0.004033487 0.005089692 0.005271460 0.006732973 0.007319472 0.007814524 0.009075475 0.009828945 0.012132308 0.014489015 0.016135971 0.018390375 0.020823380 0.021493427 0.025805910 0.028599741 0.032324543 0.033157126 0.037374681 0.039151536 0.043110253 0.045243360 0.047105984 0.049334013 0.050296634 0.050574645 0.051219814 0.052697592 0.054307628 0.054683117 0.055003705 0.055577409 0.056416614 0.059809616 0.061742866 0.063253840 0.067678324 0.068374744 0.071210137 0.072435573 0.074365720 0.076750768 0.077461182 0.079889217 0.082672411 0.087594291 0.089213115 0.094074560 0.099182616 0.103841115 0.105173572 0.107232112 0.110380052 0.113685064 0.114502879 0.114824075 0.117510959 0.122914141 0.127105020 0.132967413 0.138237963 0.147202486 0.151585036 0.153581291 0.158703861 0.166286222 0.171169271 0.174254730 0.177630449 0.182124869 0.189982579 0.206983217 0.210259816 0.213489801 0.224730252 0.239825159 0.256565152 0.268866214 0.296686828 0.310630500 0.357034776 0.366101861 0.385281830 0.434682174 0.460019645 0.508261491 0.541685399 0.561727353 0.599948528 0.635136494 0.655973109 0.695794828 0.749899372 0.757451865 0.762436685 0.768090809 0.771397212 0.776797367 0.785871779 0.790834635 0.795178112 0.800420166 0.808640590 0.810483516 0.823468348 0.836507250 0.840305625 0.848846214 0.858007801 0.869348768 0.880368469 0.888771268 0.894510961 0.917354299 0.921249611 0.921752589 0.924828904 0.938130448 1.032863278 1.072303799 1.264343354 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:-4.2381,-1.908,2.6924;-3.2011,-1.5561,2.8501;-4.7261,-1.1897,2.0117;-4.1854,-2.8833,2.1714;-5.0134,-2.0236,4.0051;-6.0724,-2.2505,3.7805;-5.0182,-1.041,4.5114;-4.4968,-3.1118,4.9534;-4.5749,-4.0865,4.4382;-5.1567,-3.1819,5.8368;-3.0421,-2.9598,5.4377;-2.3734,-2.7646,4.5826;-2.726,-3.91,5.8971;-2.8345,-1.8997,6.4895;-1.8112,.3896,6.9623;-1.905,.1986,8.0409;-2.1308,1.4325,6.7978;-.345,.2903,6.5022;.2237,1.1118,6.9786;-.3227,.5009,5.4169;.383,-1.0351,6.7649;1.1906,-1.1387,6.0183;-.3012,-1.884,6.5787;1.0178,-1.192,8.1519;1.7937,-.4131,8.2785;1.5548,-2.158,8.1687;.055,-1.1433,9.3374;-.7958,-1.8299,9.1877;.5703,-1.4309,10.2701;-.3537,-.1301,9.4919;-2.8811,-2.3042,7.7173;-3.4719,-1.5301,8.2708;-2.7354,-.5337,6.1963;-2.8237,-.2928,5.1281;-4.8333,3.7327,7.6502;-4.2004,4.061,6.806;-4.6397,4.4124,8.4975;-5.8872,3.8669,7.3477;-4.5433,2.2837,8.0297;-3.4942,2.1824,8.3491;-5.1467,1.9902,8.9047;-4.838,1.3162,6.8847;-4.3159,1.6232,5.9613;-5.917,1.3674,6.6393;-4.5519,-.1465,7.2052;-4.2762,-.4844,8.3996;-5.1659,-.8473,6.6034; -739.258655177289 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001848115018 0.000408419270 0.027151584192 0.008427570273 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124608068 -0.000491122 0.000168627 0.000289630 0.000400521 0.000490113 0.000589092 0.000964009 0.001002110 0.001687262 0.002139479 0.002739536 0.002951911 0.003545748 0.004124309 0.005093282 0.005272558 0.006735720 0.007326977 0.007816263 0.009075452 0.009829413 0.012133888 0.014489186 0.016137480 0.018390325 0.020823521 0.021493529 0.025805815 0.028599681 0.032355853 0.033157362 0.037375520 0.039152299 0.043112774 0.045243362 0.047106049 0.049334273 0.050296735 0.050574528 0.051224109 0.052698575 0.054308521 0.054682523 0.055003959 0.055577042 0.056429859 0.059844644 0.061743258 0.063253825 0.067680745 0.068375140 0.071230048 0.072435650 0.074367540 0.076798884 0.077461430 0.079899221 0.082677638 0.087594334 0.089225926 0.094074489 0.099182347 0.103841020 0.105173604 0.107236391 0.110383905 0.113698540 0.114504892 0.114825736 0.117511998 0.122920151 0.127105158 0.132991952 0.138237545 0.147208532 0.151595243 0.153584388 0.158703821 0.166286802 0.171191820 0.174381869 0.177630337 0.182129667 0.189990176 0.207119282 0.210356341 0.214001054 0.224774165 0.239842231 0.256821258 0.268891345 0.296686778 0.310630564 0.357466280 0.366149562 0.385291208 0.434686992 0.460137277 0.508275573 0.541685740 0.561737670 0.599949889 0.635138600 0.655978256 0.695805778 0.749899925 0.757451839 0.762437745 0.768094360 0.771399852 0.776797296 0.785872193 0.790835092 0.795212904 0.800475195 0.808640768 0.810485424 0.823468636 0.836508109 0.840323941 0.849020492 0.858010017 0.869364591 0.880685326 0.888772660 0.894511216 0.917440856 0.921282865 0.921782190 0.924828924 0.938131091 1.032864060 1.072307476 1.264345209 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:-4.2579,-1.9174,2.6845;-3.228,-1.5551,2.8374;-4.7532,-1.2086,1.9996;-4.1969,-2.8924,2.1717;-5.0243,-2.0313,4.0003;-6.0812,-2.2632,3.7817;-5.0307,-1.0478,4.5009;-4.499,-3.1126,4.9518;-4.58,-4.0907,4.4429;-5.1523,-3.1782,5.8411;-3.0405,-2.9552,5.4245;-2.3794,-2.755,4.5645;-2.7169,-3.9051,5.879;-2.8296,-1.8977,6.4787;-1.8067,.391,6.9576;-1.9054,.201,8.0361;-2.1245,1.4342,6.7911;-.338,.2902,6.5048;.2284,1.1128,6.9825;-.3097,.4982,5.419;.3887,-1.0345,6.7747;1.2011,-1.1398,6.0329;-.2946,-1.8839,6.5865;1.0161,-1.1876,8.166;1.7928,-.4094,8.2943;1.5517,-2.1543,8.1888;.047,-1.1334,9.3467;-.8048,-1.8189,9.1946;.5569,-1.4192,10.2833;-.3603,-.119,9.4962;-2.875,-2.3054,7.7053;-3.4668,-1.5328,8.261;-2.7301,-.531,6.1889;-2.8194,-.2879,5.1212;-4.8287,3.7305,7.6595;-4.2013,4.0624,6.8128;-4.6309,4.4074,8.5081;-5.8846,3.8647,7.3637;-4.5348,2.2805,8.032;-3.4842,2.1796,8.3465;-5.1339,1.9826,8.9085;-4.8329,1.317,6.8845;-4.3135,1.6268,5.9605;-5.9126,1.3691,6.6426;-4.5464,-.147,7.1991;-4.2708,-.4892,8.3925;-5.1605,-.8454,6.5948; -739.258652869934 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001587054133 0.000325226274 0.026438570176 0.008316870976 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124607867 -0.000343107 0.000175843 0.000288405 0.000407532 0.000492147 0.000589230 0.000965101 0.001006851 0.001687145 0.002389347 0.002742920 0.002958056 0.003545866 0.004209531 0.005108272 0.005272346 0.006741435 0.007336773 0.007820333 0.009081569 0.009835179 0.012134911 0.014489287 0.016136877 0.018390470 0.020823578 0.021494063 0.025805792 0.028600068 0.032420902 0.033158473 0.037377602 0.039153907 0.043115493 0.045244804 0.047106019 0.049334161 0.050296690 0.050574432 0.051223676 0.052701663 0.054310992 0.054687665 0.055003753 0.055575787 0.056430272 0.059857815 0.061745523 0.063254701 0.067681089 0.068376701 0.071238805 0.072435897 0.074367247 0.076859938 0.077461368 0.079908024 0.082687446 0.087595265 0.089238792 0.094075459 0.099183000 0.103841314 0.105174140 0.107235663 0.110383995 0.113719361 0.114504501 0.114826322 0.117512104 0.122928839 0.127108135 0.133016046 0.138238925 0.147207945 0.151599079 0.153593981 0.158703808 0.166290539 0.171237559 0.174586455 0.177630130 0.182133111 0.189990382 0.207156374 0.210490063 0.214234008 0.224795321 0.239894543 0.256904654 0.268890414 0.296694847 0.310631123 0.357933821 0.366173719 0.385293057 0.434703453 0.460313172 0.508280816 0.541685774 0.561750494 0.599955892 0.635139334 0.655989301 0.695825158 0.749899896 0.757452281 0.762438638 0.768128237 0.771438748 0.776804643 0.785874116 0.790836377 0.795248053 0.800545929 0.808650176 0.810489691 0.823469565 0.836510500 0.840345594 0.849169377 0.858014142 0.869372100 0.880928562 0.888814512 0.894514406 0.917576209 0.921295625 0.921795428 0.924830349 0.938132344 1.032864429 1.072307602 1.264344974 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:-4.2378,-1.9073,2.6947;-3.207,-1.5477,2.8569;-4.7268,-1.1946,2.0092;-4.1749,-2.8813,2.1778;-5.016,-2.0252,4.0036;-6.0718,-2.2554,3.7752;-5.026,-1.0434,4.5083;-4.4995,-3.1108,4.9548;-4.5792,-4.0869,4.4423;-5.1589,-3.1777,5.8391;-3.044,-2.9593,5.4375;-2.3763,-2.7651,4.5814;-2.7284,-3.9094,5.8969;-2.8341,-1.8992,6.4891;-1.8098,.3897,6.9622;-1.904,.1987,8.0408;-2.1294,1.4327,6.7978;-.343,.2911,6.5031;.2252,1.112,6.9813;-.3196,.5031,5.4181;.3852,-1.0345,6.7646;1.1939,-1.1366,6.0186;-.2988,-1.8832,6.5761;1.0188,-1.1932,8.1521;1.7951,-.4149,8.2805;1.5554,-2.1594,8.1681;.0548,-1.1456,9.3371;-.7967,-1.8313,9.1855;.5691,-1.4349,10.2699;-.3532,-.1323,9.4928;-2.88,-2.3036,7.7169;-3.4707,-1.5292,8.2705;-2.734,-.5334,6.1959;-2.8227,-.2925,5.1277;-4.8361,3.7328,7.6498;-4.2061,4.0622,6.8038;-4.6413,4.4128,8.4965;-5.8912,3.8652,7.3502;-4.5425,2.2841,8.0285;-3.4927,2.1848,8.3463;-5.144,1.9892,8.9045;-4.8373,1.3163,6.8839;-4.3156,1.6234,5.9602;-5.9163,1.3669,6.6389;-4.5504,-.1463,7.2045;-4.2747,-.4839,8.399;-5.1644,-.8472,6.6028; -739.258665634035 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000438332804 0.000093247416 0.037390942124 0.008400752346 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124608199 -0.000207568 0.000062250 0.000190618 0.000397940 0.000488932 0.000569870 0.000953430 0.001000156 0.001674613 0.001973677 0.002747994 0.002962778 0.003546265 0.004142013 0.005118753 0.005270989 0.006751673 0.007354112 0.007827168 0.009088587 0.009840084 0.012137586 0.014489003 0.016133883 0.018391013 0.020824860 0.021495232 0.025805909 0.028600686 0.032541044 0.033160641 0.037381883 0.039157093 0.043118749 0.045246378 0.047105503 0.049333602 0.050296957 0.050574643 0.051217165 0.052706563 0.054313949 0.054691853 0.055004036 0.055576980 0.056427402 0.059880911 0.061749830 0.063258642 0.067676890 0.068378714 0.071246901 0.072435800 0.074365225 0.076988656 0.077466856 0.079922129 0.082703473 0.087596290 0.089259527 0.094076761 0.099183443 0.103842095 0.105174827 0.107231015 0.110381783 0.113749040 0.114502781 0.114826804 0.117511692 0.122944167 0.127111783 0.133063220 0.138246206 0.147204731 0.151611636 0.153629035 0.158703962 0.166294903 0.171293421 0.174949580 0.177631166 0.182141718 0.189987786 0.207185948 0.210710970 0.214737545 0.224812183 0.239989204 0.257058373 0.268881413 0.296718065 0.310635412 0.358692988 0.366220376 0.385296374 0.434724629 0.460594520 0.508292842 0.541686112 0.561774446 0.599964629 0.635142416 0.656001357 0.695847148 0.749902897 0.757452886 0.762439640 0.768169965 0.771498599 0.776814502 0.785877060 0.790838700 0.795300175 0.800666046 0.808666554 0.810496379 0.823471784 0.836513457 0.840371856 0.849358380 0.858019236 0.869383524 0.881262072 0.888900185 0.894520648 0.917778849 0.921306512 0.921813875 0.924833105 0.938133346 1.032865371 1.072308176 1.264347161 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:-4.2349,-1.9036,2.7031;-3.2058,-1.5358,2.8661;-4.7275,-1.1978,2.013;-4.1639,-2.8802,2.1903;-5.0168,-2.0228,4.0103;-6.0724,-2.2551,3.7793;-5.0298,-1.0408,4.5156;-4.5005,-3.1079,4.9621;-4.5819,-4.0842,4.4506;-5.1588,-3.1734,5.847;-3.044,-2.9578,5.4422;-2.3776,-2.7662,4.5845;-2.7291,-3.9076,5.9029;-2.8308,-1.8963,6.4918;-1.8036,.3918,6.9627;-1.8986,.2016,8.0414;-2.1228,1.4348,6.7976;-.3364,.2928,6.5048;.2323,1.1109,6.9871;-.3115,.5095,5.4207;.3905,-1.0346,6.7606;1.202,-1.1316,6.0167;-.2931,-1.8819,6.5635;1.0195,-1.2035,8.1494;1.7952,-.4256,8.2866;1.5569,-2.1695,8.1592;.0515,-1.1664,9.332;-.7997,-1.8509,9.1717;.563,-1.4637,10.264;-.3571,-.1546,9.4955;-2.8773,-2.2988,7.7202;-3.4662,-1.5222,8.2728;-2.7281,-.5311,6.1965;-2.8166,-.2914,5.1279;-4.859,3.7355,7.6439;-4.2435,4.0719,6.79;-4.6628,4.4187,8.4877;-5.9193,3.8545,7.3569;-4.5434,2.2911,8.0206;-3.4899,2.2055,8.3302;-5.1343,1.9887,8.9012;-4.8342,1.3191,6.8787;-4.3125,1.6248,5.9546;-5.9132,1.3661,6.6326;-4.5448,-.1418,7.2042;-4.2681,-.4754,8.3996;-5.1583,-.8454,6.6054; -739.258662588369 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000813082795 0.000154285644 0.028636255197 0.008413185772 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124608191 -0.000069391 0.000182913 0.000242997 0.000398936 0.000516520 0.000595407 0.000974020 0.001009976 0.001681282 0.001994844 0.002748003 0.002963810 0.003546589 0.004141606 0.005119720 0.005274406 0.006751667 0.007354124 0.007827449 0.009088557 0.009844612 0.012138858 0.014488965 0.016134106 0.018390967 0.020826251 0.021495421 0.025806339 0.028600703 0.032560034 0.033160686 0.037381839 0.039157018 0.043121024 0.045246349 0.047105612 0.049333805 0.050298151 0.050574762 0.051218753 0.052706638 0.054315231 0.054694642 0.055005427 0.055580869 0.056431105 0.059884331 0.061751923 0.063259264 0.067677812 0.068379098 0.071246992 0.072435995 0.074366894 0.076996871 0.077467492 0.079922098 0.082702928 0.087596547 0.089260902 0.094076785 0.099183824 0.103842227 0.105176737 0.107231549 0.110382188 0.113750109 0.114503132 0.114827127 0.117511848 0.122945128 0.127112269 0.133085684 0.138246044 0.147205946 0.151618424 0.153640585 0.158714118 0.166296336 0.171293613 0.174968476 0.177634038 0.182141749 0.189990916 0.207186742 0.210713548 0.214838701 0.224818284 0.239996851 0.257102112 0.268896862 0.296718646 0.310651435 0.358737774 0.366241990 0.385299158 0.434729191 0.460633187 0.508295392 0.541686324 0.561774670 0.599964998 0.635145570 0.656001923 0.695847217 0.749903673 0.757452859 0.762439499 0.768171683 0.771501513 0.776818551 0.785877244 0.790839068 0.795310274 0.800679683 0.808666799 0.810500011 0.823474406 0.836516791 0.840372603 0.849376334 0.858019219 0.869386617 0.881389150 0.888903251 0.894527267 0.917789092 0.921325302 0.921819168 0.924838098 0.938133365 1.032868340 1.072308125 1.264347815 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:-4.2164,-1.8945,2.708;-3.187,-1.5362,2.8825;-4.6989,-1.1779,2.0218;-4.1486,-2.8659,2.1864;-5.0072,-2.0177,4.0089;-6.0609,-2.2473,3.7696;-5.0224,-1.0377,4.5174;-4.4999,-3.1067,4.9614;-4.5796,-4.0817,4.4467;-5.1651,-3.1729,5.8413;-3.047,-2.9618,5.4535;-2.3724,-2.7748,4.6013;-2.7401,-3.9122,5.9185;-2.8372,-1.899,6.5021;-1.8092,.389,6.9692;-1.8994,.1968,8.0479;-2.1299,1.432,6.8073;-.3442,.2917,6.5041;.2268,1.1086,6.9859;-.3247,.5114,5.4205;.3837,-1.0366,6.7526;1.1887,-1.134,6.0023;-.3018,-1.8832,6.5606;1.0234,-1.2073,8.1356;1.7998,-.4299,8.2671;1.5605,-2.1735,8.1408;.0649,-1.1705,9.325;-.7863,-1.8556,9.1717;.5837,-1.4672,10.2529;-.3435,-.159,9.491;-2.885,-2.2995,7.7312;-3.4723,-1.5217,8.2825;-2.7349,-.5342,6.205;-2.822,-.2963,5.136;-4.8613,3.7376,7.6342;-4.2391,4.069,6.7832;-4.6693,4.4242,8.4762;-5.9194,3.8574,7.3393;-4.5513,2.2938,8.0193;-3.4991,2.2068,8.3338;-5.1468,1.9972,8.8989;-4.8404,1.3175,6.8805;-4.3173,1.6201,5.9561;-5.9191,1.3638,6.6326;-4.551,-.1424,7.211;-4.2743,-.4724,8.4074;-5.1646,-.848,6.6142; -739.258669317602 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000355156639 0.000095101055 0.032340849968 0.008415603774 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124606703 0.000047989 0.000155574 0.000230145 0.000412763 0.000513849 0.000610313 0.000975102 0.001057845 0.001691365 0.001899975 0.002749159 0.002963963 0.003546284 0.004133470 0.005124303 0.005280414 0.006750797 0.007353256 0.007828359 0.009095169 0.009834497 0.012140965 0.014489319 0.016135774 0.018391304 0.020824200 0.021497637 0.025807122 0.028600790 0.032575596 0.033160495 0.037381426 0.039156790 0.043125955 0.045246178 0.047104647 0.049334083 0.050301648 0.050576057 0.051218759 0.052706972 0.054316822 0.054699292 0.055007727 0.055583284 0.056436428 0.059887964 0.061751998 0.063257741 0.067679220 0.068380208 0.071247300 0.072441368 0.074366934 0.076992970 0.077474375 0.079922565 0.082702674 0.087596577 0.089266842 0.094077103 0.099184042 0.103841618 0.105177136 0.107234237 0.110382696 0.113751239 0.114505353 0.114827263 0.117511713 0.122944972 0.127112917 0.133094404 0.138246807 0.147206991 0.151621066 0.153652251 0.158717519 0.166297026 0.171294819 0.174947886 0.177641319 0.182143154 0.189991207 0.207203509 0.210711556 0.214876248 0.224838117 0.239997535 0.257118306 0.268896313 0.296719465 0.310658393 0.358733850 0.366246804 0.385301967 0.434727234 0.460652811 0.508301764 0.541686329 0.561778138 0.599965976 0.635146071 0.656003205 0.695849649 0.749904310 0.757453008 0.762439579 0.768175682 0.771508342 0.776818830 0.785877143 0.790839133 0.795310971 0.800678270 0.808668989 0.810503010 0.823475978 0.836516747 0.840373081 0.849387743 0.858019485 0.869387553 0.881388818 0.888903705 0.894535723 0.917787381 0.921338106 0.921821790 0.924839541 0.938137322 1.032868170 1.072321191 1.264351129 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:-4.1944,-1.8876,2.7164;-3.1641,-1.5343,2.8996;-4.6665,-1.1688,2.0253;-4.127,-2.86,2.1956;-4.9985,-2.0091,4.0094;-6.051,-2.2337,3.7596;-5.0148,-1.0299,4.5195;-4.5047,-3.1023,4.9641;-4.5858,-4.076,4.4474;-5.1772,-3.1662,5.8384;-3.0545,-2.9674,5.4668;-2.3727,-2.7889,4.6182;-2.7585,-3.9186,5.937;-2.8421,-1.9019,6.5126;-1.8135,.3873,6.9731;-1.8987,.1938,8.052;-2.1376,1.4296,6.8136;-.3503,.2945,6.5015;.2211,1.111,6.9833;-.3363,.5179,5.4186;.3816,-1.0331,6.7418;1.1845,-1.1254,5.9882;-.3031,-1.8805,6.5482;1.0264,-1.2081,8.1223;1.8023,-.4297,8.2546;1.5652,-2.1733,8.1216;.0713,-1.1776,9.3152;-.781,-1.8621,9.1608;.593,-1.4788,10.2403;-.3364,-.1669,9.4876;-2.8882,-2.2987,7.7429;-3.4758,-1.5195,8.2922;-2.7392,-.538,6.2117;-2.8267,-.3023,5.1424;-4.8613,3.737,7.6267;-4.2329,4.0632,6.7781;-4.6716,4.4258,8.4675;-5.9173,3.8597,7.3252;-4.5586,2.2933,8.0185;-3.5083,2.2033,8.3386;-5.1596,2.0018,8.8962;-4.8456,1.3142,6.8816;-4.321,1.6147,5.9574;-5.9238,1.3594,6.6316;-4.5559,-.1447,7.2165;-4.279,-.471,8.4138;-5.1691,-.8523,6.6217; -739.258669155631 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000348395815 0.000081636371 0.018678894980 0.005519757570 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.124608866 0.000099012 0.000152269 0.000242466 0.000420700 0.000501113 0.000628398 0.000971955 0.001081991 0.001693241 0.001826735 0.002751127 0.002962302 0.003545892 0.004095299 0.005105775 0.005278134 0.006742112 0.007343416 0.007826611 0.009089481 0.009833659 0.012141449 0.014489399 0.016137073 0.018391800 0.020823957 0.021496570 0.025808791 0.028601248 0.032557013 0.033160425 0.037380969 0.039156490 0.043123909 0.045246608 0.047103816 0.049334088 0.050302827 0.050574158 0.051218860 0.052706218 0.054315872 0.054697287 0.055009061 0.055585645 0.056434790 0.059889593 0.061752166 0.063257917 0.067679154 0.068380882 0.071239508 0.072434725 0.074359653 0.076989811 0.077471571 0.079922252 0.082703382 0.087596310 0.089262023 0.094077072 0.099184676 0.103841748 0.105177527 0.107234115 0.110382484 0.113753333 0.114505255 0.114827108 0.117512096 0.122944496 0.127113642 0.133078163 0.138241769 0.147207402 0.151616182 0.153623362 0.158721476 0.166294418 0.171292713 0.174942834 0.177640758 0.182145748 0.189992415 0.207223703 0.210704988 0.214876037 0.224861559 0.239985863 0.257116890 0.268897097 0.296718865 0.310678095 0.358731305 0.366245633 0.385302757 0.434721777 0.460656139 0.508293162 0.541686547 0.561776002 0.599965022 0.635146234 0.656000860 0.695849457 0.749894826 0.757452870 0.762439591 0.768168980 0.771516275 0.776812568 0.785877387 0.790837808 0.795311495 0.800678297 0.808671107 0.810506108 0.823475431 0.836516525 0.840371863 0.849388006 0.858019977 0.869390992 0.881389308 0.888910832 0.894538420 0.917787663 0.921307170 0.921821513 0.924837912 0.938134231 1.032866719 1.072311672 1.264351028 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:-4.2067,-1.8933,2.7103;-3.1775,-1.5355,2.8885;-4.6852,-1.1776,2.0205;-4.1374,-2.866,2.1907;-5.0041,-2.0152,4.0073;-6.0571,-2.2432,3.7629;-5.0205,-1.0353,4.516;-4.5029,-3.1054,4.9614;-4.583,-4.08,4.4464;-5.1713,-3.1702,5.8388;-3.0512,-2.9645,5.4581;-2.3738,-2.781,4.6073;-2.7488,-3.9152,5.9251;-2.8401,-1.9006,6.5056;-1.8124,.3879,6.9705;-1.9003,.1947,8.0492;-2.1348,1.4306,6.81;-.3481,.2932,6.5026;.2226,1.1105,6.9838;-.3312,.5138,5.4192;.382,-1.0343,6.7486;1.1858,-1.1301,5.9966;-.3031,-1.8816,6.5573;1.0245,-1.2049,8.1305;1.8012,-.4271,8.2608;1.5619,-2.1708,8.1344;.068,-1.1684,9.3217;-.7842,-1.8532,9.1694;.5882,-1.4657,10.2487;-.3396,-.1568,9.4889;-2.8868,-2.2998,7.7351;-3.4753,-1.5222,8.2855;-2.7379,-.5362,6.2072;-2.8254,-.2988,5.1382;-4.8548,3.7364,7.6338;-4.2265,4.0641,6.7858;-4.6637,4.4225,8.4764;-5.9108,3.8616,7.3332;-4.554,2.2913,8.0212;-3.5038,2.199,8.3404;-5.1549,1.9983,8.8983;-4.843,1.3157,6.8818;-4.3188,1.6182,5.9581;-5.9213,1.3628,6.6328;-4.5547,-.1444,7.2125;-4.2787,-.4743,8.409;-5.168,-.8497,6.6152; -739.258670957084 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 -899.68189318 27.60657791 37.73383307 42.29272052 57.98309644 68.17338163 81.28942376 97.92255573 110.96736776 125.13467755 133.46497922 142.53933551 181.10683074 193.88236136 210.91634168 214.12905287 252.94974303 263.14758238 270.95531870 275.53199191 305.93198610 317.04839135 325.55072481 353.09597826 400.66630593 425.54345339 460.46747515 471.61056924 494.04690514 526.65851493 553.98999086 698.15653795 729.04144504 745.44701002 757.50118073 780.00955956 800.61036628 814.77117200 832.71897772 847.08602399 861.85079184 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