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:-5.1431,-1.3104,1.1534;-4.9306,-2.3895,1.0478;-4.1779,-.7748,1.1308;-5.7138,-.9916,.2646;-5.9252,-1.0295,2.4354;-6.9272,-1.4872,2.3536;-6.0949,.0596,2.5332;-5.2627,-1.5575,3.7103;-5.133,-2.6512,3.644;-5.9397,-1.3802,4.5655;-3.904,-.9168,4.0097;-3.9807,.1843,4.0277;-3.1863,-1.1643,3.2043;-3.2796,-1.3894,5.2931;-1.6312,-.9652,7.1684;-.9968,-1.6831,6.6191;-2.0251,-1.5361,8.0307;-.7882,.2128,7.6576;-1.4556,.9878,8.0778;-.2822,.6834,6.7928;.2503,-.161,8.7163;-.2702,-.5619,9.6078;.7634,.7608,9.049;1.3005,-1.1717,8.2526;1.767,-.8059,7.318;.8114,-2.129,7.9976;2.3822,-1.4267,9.2991;1.944,-1.8177,10.2348;3.1229,-2.1627,8.9423;2.924,-.4967,9.548;-3.3445,-2.6571,5.5532;-3.6738,-2.7065,6.5991;-2.7626,-.524,6.2579;-2.7921,.5392,5.9966;-4.5378,2.5063,9.314;-5.3709,2.2475,9.991;-4.6827,3.5495,8.985;-3.6042,2.4665,9.9032;-4.4744,1.553,8.1228;-5.4074,1.6353,7.5342;-3.659,1.8738,7.4517;-4.2687,.1001,8.5439;-5.0521,-.1775,9.276;-3.311,-.0361,9.0751;-4.4046,-.9438,7.449;-4.221,-2.1674,7.737;-5.2084,-.6878,6.7206; -739.263455089372 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.006191351832 0.000851945585 0.040547361970 0.008421235772 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.078200303 0.000059924 0.000062196 0.000143977 0.000191787 0.000252519 0.000440744 0.000613266 0.000820304 0.000966207 0.001123256 0.001535665 0.002858524 0.002956706 0.003131778 0.004008651 0.004548546 0.004968387 0.006296557 0.007403537 0.008208388 0.011163332 0.011944585 0.012517542 0.017844493 0.018732789 0.020529108 0.024319279 0.024507961 0.028671722 0.029608488 0.032480035 0.034510700 0.035637303 0.037228108 0.038740853 0.039559656 0.040566570 0.046544215 0.047370393 0.049907189 0.051668546 0.052180092 0.053226503 0.053753844 0.054549964 0.057597276 0.060144685 0.063619806 0.065433008 0.066357130 0.068266456 0.072825168 0.075690830 0.076007355 0.076925607 0.077601340 0.080022174 0.081490185 0.084985311 0.089882661 0.092344636 0.099046325 0.102405389 0.108532409 0.111372325 0.112305967 0.113870943 0.115437552 0.117433237 0.121385765 0.128740972 0.132753965 0.137162255 0.139698576 0.142046771 0.148593997 0.150248545 0.154393249 0.159241955 0.167299731 0.176372684 0.185193524 0.187754559 0.197638941 0.199151963 0.204884591 0.216636491 0.223183571 0.229646110 0.259490290 0.273189005 0.298477251 0.318889043 0.349170039 0.380164256 0.401653220 0.466636383 0.477997503 0.538536826 0.554638636 0.586781947 0.608113414 0.610418270 0.629983375 0.709179689 0.752381019 0.754899025 0.767129716 0.769901439 0.777494831 0.779973253 0.781070068 0.792294905 0.795261960 0.798275175 0.810637018 0.821153873 0.823726618 0.825860255 0.841957922 0.850347800 0.854819632 0.868582461 0.877971681 0.902015961 0.902596969 0.905439190 0.919752772 0.924303860 0.928682134 0.934668725 1.048030284 1.166926607 1.334082179 2 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1453,-1.3138,1.1504;-4.9306,-2.3923,1.0435;-4.1812,-.7762,1.1284;-5.7169,-.9951,.2621;-5.9275,-1.036,2.4331;-6.9287,-1.4955,2.351;-6.0992,.0527,2.5318;-5.2628,-1.5632,3.7071;-5.1314,-2.6568,3.641;-5.9399,-1.3875,4.5628;-3.9052,-.9204,4.0051;-3.9834,.1807,4.0196;-3.1878,-1.169,3.1999;-3.278,-1.3908,5.2896;-1.6216,-.9595,7.1587;-.9809,-1.6763,6.6147;-2.0224,-1.5324,8.0166;-.7824,.2172,7.6598;-1.453,.9889,8.0813;-.273,.6941,6.8003;.253,-.1606,8.7204;-.2697,-.5649,9.6091;.7653,.7599,9.0582;1.3047,-1.1695,8.2558;1.7719,-.8017,7.3223;.8165,-2.1266,7.9984;2.3856,-1.4263,9.3026;1.9468,-1.8177,10.2378;3.1258,-2.1626,8.9454;2.9283,-.4969,9.5526;-3.3538,-2.6538,5.5602;-3.7143,-2.6882,6.6174;-2.7437,-.5177,6.2388;-2.7624,.5439,5.9666;-4.532,2.5028,9.3233;-5.3642,2.2466,10.0027;-4.6728,3.5471,8.9967;-3.5965,2.4562,9.9088;-4.4787,1.552,8.1303;-5.4138,1.6395,7.5458;-3.6639,1.8657,7.4553;-4.2795,.0982,8.5474;-5.0611,-.1787,9.2824;-3.32,-.0484,9.0728;-4.4227,-.934,7.4481;-4.2411,-2.1595,7.7297;-5.2142,-.6742,6.7094; -739.263705368477 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001614420374 0.000253159197 0.030968391066 0.008423021947 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.078217140 0.000059745 0.000067435 0.000187584 0.000201006 0.000271425 0.000462026 0.000619205 0.000851629 0.000966521 0.001144771 0.001664324 0.002870981 0.002962739 0.003132768 0.004055365 0.004544629 0.004962512 0.006280130 0.007430703 0.008163242 0.010993443 0.011678128 0.012462237 0.017661386 0.018734756 0.020445197 0.024209511 0.024418661 0.028669106 0.029607643 0.032474567 0.034494526 0.035637241 0.037184783 0.038742677 0.039556133 0.040563016 0.046544184 0.047338893 0.049906306 0.051668335 0.052172343 0.053226759 0.053753689 0.054547534 0.057586984 0.060122500 0.063624927 0.065433578 0.066357138 0.068266778 0.072823646 0.075689789 0.076006357 0.076924402 0.077601292 0.080021563 0.081487603 0.084980807 0.089882646 0.092334605 0.099045399 0.102405412 0.108532851 0.111367288 0.112305910 0.113868240 0.115437360 0.117428082 0.121373276 0.128740317 0.132752801 0.137159454 0.139699164 0.142044903 0.148583229 0.150240283 0.154391880 0.159242413 0.167299540 0.176371839 0.185189232 0.187754355 0.197636094 0.199144061 0.204881479 0.216631536 0.223184947 0.229646675 0.259492481 0.273172880 0.298468101 0.318775876 0.349167396 0.380116518 0.401582880 0.465968423 0.477917473 0.538506447 0.554623048 0.586760380 0.608113294 0.610415513 0.629956988 0.709167593 0.752380240 0.754898306 0.767128686 0.769897775 0.777494686 0.779972628 0.781069018 0.792294836 0.795260415 0.798275148 0.810636996 0.821150965 0.823726448 0.825860001 0.841947536 0.850347323 0.854819618 0.868575633 0.877971549 0.902015923 0.902596375 0.905438217 0.919748783 0.924302560 0.928675544 0.934656527 1.047776665 1.166925999 1.334069222 3 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1492,-1.3202,1.1456;-4.9285,-2.3976,1.039;-4.1881,-.7773,1.1228;-5.7232,-1.0051,.2575;-5.9322,-1.0463,2.4287;-6.9307,-1.5117,2.3474;-6.1101,.0415,2.5269;-5.2636,-1.569,3.7026;-5.1259,-2.6618,3.6368;-5.9416,-1.3974,4.5585;-3.9096,-.9187,4.0001;-3.9937,.182,4.0152;-3.1916,-1.1628,3.194;-3.2783,-1.3875,5.2839;-1.6195,-.9558,7.1508;-.9734,-1.668,6.6068;-2.0242,-1.5348,8.003;-.7858,.2196,7.6644;-1.4603,.9866,8.0882;-.2735,.7041,6.8108;.2459,-.1623,8.7273;-.2795,-.5752,9.6106;.7531,.7577,9.0744;1.3042,-1.1637,8.2607;1.7737,-.7879,7.3315;.8213,-2.1213,7.9952;2.382,-1.4223,9.3103;1.9412,-1.8203,10.2418;3.1261,-2.1542,8.9519;2.9206,-.4925,9.5673;-3.3553,-2.6495,5.5566;-3.7236,-2.6819,6.617;-2.7369,-.513,6.2266;-2.7539,.5481,5.9525;-4.5069,2.5008,9.3329;-5.3341,2.2492,10.0203;-4.6421,3.5476,9.0118;-3.5655,2.4438,9.9083;-4.4745,1.5538,8.1358;-5.4151,1.6513,7.5614;-3.6637,1.8608,7.453;-4.2834,.0973,8.5466;-5.0656,-.1787,9.2815;-3.324,-.0572,9.0701;-4.4314,-.9294,7.4443;-4.2489,-2.1554,7.7211;-5.2179,-.6659,6.7021; -739.263738962870 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000513908722 0.000100608634 0.034681997021 0.008423139965 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.078345699 0.000058013 0.000064448 0.000170841 0.000217139 0.000260113 0.000447379 0.000642651 0.000845722 0.000967237 0.001136500 0.001643011 0.002867752 0.002958126 0.003134080 0.004053590 0.004531060 0.004961003 0.006273283 0.007416732 0.008171914 0.010968592 0.011648169 0.012459785 0.017663017 0.018734743 0.020451633 0.024220817 0.024426945 0.028669169 0.029608014 0.032475089 0.034495355 0.035637424 0.037191228 0.038742708 0.039555937 0.040562686 0.046544430 0.047339206 0.049906156 0.051669708 0.052174394 0.053226720 0.053753589 0.054548257 0.057588928 0.060129119 0.063625098 0.065434071 0.066357041 0.068266933 0.072823810 0.075689754 0.076006628 0.076925253 0.077601348 0.080021672 0.081489155 0.084982658 0.089882514 0.092334359 0.099045537 0.102405570 0.108532269 0.111368537 0.112305892 0.113868887 0.115437521 0.117428244 0.121376882 0.128740614 0.132753031 0.137159413 0.139699184 0.142045434 0.148583896 0.150241225 0.154391133 0.159242368 0.167299486 0.176372117 0.185188644 0.187754473 0.197635785 0.199144457 0.204880957 0.216630618 0.223182296 0.229644876 0.259490266 0.273173169 0.298468325 0.318778446 0.349167412 0.380115267 0.401584173 0.465980656 0.477918529 0.538506009 0.554623061 0.586760462 0.608113052 0.610415238 0.629956812 0.709167368 0.752380213 0.754898150 0.767128322 0.769897767 0.777494427 0.779972569 0.781068937 0.792294433 0.795260283 0.798275038 0.810636330 0.821150983 0.823726251 0.825859858 0.841947319 0.850347296 0.854819239 0.868575559 0.877971531 0.902013580 0.902596150 0.905437403 0.919748747 0.924299278 0.928675536 0.934656448 1.047774683 1.166923625 1.334067409 4 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1518,-1.3276,1.1396;-4.9268,-2.4042,1.0347;-4.1929,-.7809,1.1158;-5.727,-1.0162,.251;-5.9358,-1.0547,2.4223;-6.9324,-1.5243,2.3416;-6.1182,.0325,2.5187;-5.2653,-1.573,3.697;-5.1227,-2.6652,3.6321;-5.9443,-1.4038,4.5525;-3.9142,-.9168,3.995;-4.0031,.1836,4.0118;-3.1951,-1.1565,3.1885;-3.2813,-1.3854,5.2782;-1.6192,-.9538,7.1428;-.9699,-1.6611,6.5963;-2.023,-1.5381,7.9918;-.7903,.2219,7.6631;-1.4679,.9866,8.0858;-.2749,.7097,6.8133;.2371,-.1608,8.73;-.2919,-.5787,9.6087;.7394,.7594,9.0835;1.3011,-1.157,8.2654;1.7756,-.7752,7.3412;.8225,-2.1146,7.9921;2.3728,-1.4178,9.3209;1.927,-1.8221,10.2474;3.1216,-2.1454,8.9636;2.9068,-.4877,9.5864;-3.3593,-2.6471,5.5514;-3.7293,-2.6786,6.6125;-2.7381,-.511,6.2202;-2.7535,.5499,5.9446;-4.4802,2.4973,9.3446;-5.2994,2.2471,10.042;-4.6143,3.546,9.0296;-3.5315,2.4332,9.9073;-4.468,1.555,8.1434;-5.415,1.6596,7.581;-3.6641,1.8605,7.4517;-4.2796,.0963,8.5471;-5.0607,-.1808,9.2826;-3.3196,-.0628,9.0678;-4.4314,-.926,7.4413;-4.251,-2.1531,7.716;-5.2185,-.6593,6.7011; -739.263752540005 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000284861906 0.000070865884 0.035999729493 0.008422065640 0.000300000000 0.000200000000 0.001579712804 0.001053141870 -0.078349424 0.000060829 0.000081051 0.000165154 0.000200953 0.000247790 0.000437474 0.000636271 0.000843565 0.000969125 0.001132975 0.001639194 0.002867389 0.002959272 0.003134281 0.004052801 0.004536069 0.004961942 0.006275343 0.007420201 0.008172897 0.010970385 0.011653199 0.012462593 0.017663204 0.018735052 0.020451186 0.024221745 0.024428934 0.028669191 0.029608048 0.032475144 0.034495286 0.035637425 0.037191048 0.038742738 0.039555903 0.040562668 0.046544446 0.047339224 0.049906104 0.051667943 0.052173988 0.053226679 0.053753480 0.054548201 0.057588843 0.060128885 0.063624879 0.065433442 0.066356948 0.068266827 0.072823770 0.075689664 0.076006618 0.076924998 0.077601913 0.080021827 0.081489135 0.084982273 0.089882490 0.092334277 0.099045498 0.102405663 0.108532000 0.111368246 0.112305872 0.113868539 0.115437941 0.117428218 0.121377718 0.128740596 0.132753020 0.137159493 0.139698904 0.142046453 0.148583921 0.150241163 0.154390911 0.159242344 0.167299488 0.176371867 0.185188774 0.187754280 0.197635903 0.199144566 0.204880488 0.216629636 0.223174480 0.229643606 0.259489460 0.273170737 0.298467489 0.318778129 0.349167379 0.380114768 0.401582758 0.465974861 0.477917935 0.538505334 0.554622925 0.586760226 0.608113075 0.610415201 0.629956347 0.709167308 0.752380198 0.754898121 0.767128303 0.769897506 0.777494450 0.779971672 0.781068800 0.792294460 0.795260094 0.798274899 0.810636178 0.821150980 0.823726021 0.825859516 0.841947207 0.850346942 0.854817627 0.868575464 0.877971460 0.902012957 0.902596119 0.905436353 0.919748582 0.924298207 0.928675498 0.934656349 1.047773511 1.166923552 1.334067126 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:-5.1565,-1.3339,1.135;-4.9282,-2.4099,1.0312;-4.1993,-.7842,1.1094;-5.7338,-1.0255,.2468;-5.9398,-1.062,2.4184;-6.935,-1.5349,2.3394;-6.1256,.0247,2.5138;-5.2663,-1.5769,3.6928;-5.12,-2.6687,3.6284;-5.945,-1.4098,4.5489;-3.9171,-.9162,3.9894;-4.0097,.1838,4.0069;-3.1982,-1.1529,3.1818;-3.2813,-1.3836,5.2717;-1.6201,-.9513,7.1365;-.9674,-1.6544,6.5885;-2.0238,-1.54,7.9824;-.7957,.225,7.663;-1.4765,.9874,8.0847;-.2778,.7158,6.8166;.2277,-.1583,8.7335;-.3044,-.5805,9.6083;.7257,.7621,9.0925;1.2967,-1.1499,8.271;1.7757,-.7632,7.3513;.8221,-2.1075,7.9908;2.3628,-1.4126,9.3317;1.9126,-1.8223,10.2536;3.1157,-2.1365,8.9757;2.8926,-.4823,9.6047;-3.357,-2.6454,5.5453;-3.73,-2.6765,6.6054;-2.7386,-.5086,6.2132;-2.7552,.5523,5.9382;-4.4521,2.4926,9.3547;-5.2634,2.2435,10.0617;-4.5848,3.5434,9.046;-3.4965,2.4212,9.9048;-4.4601,1.5553,8.1495;-5.413,1.6679,7.5989;-3.6625,1.8588,7.4497;-4.2756,.0941,8.5455;-5.0557,-.1839,9.2818;-3.315,-.0708,9.0634;-4.433,-.9233,7.4359;-4.2564,-2.1518,7.706;-5.2191,-.6509,6.6966; -739.263761186155 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000349806560 0.000065407591 0.031503302401 0.008416682605 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.078349992 0.000060830 0.000072179 0.000170643 0.000199029 0.000243043 0.000437549 0.000635995 0.000852082 0.000969829 0.001139482 0.001640382 0.002867396 0.002959230 0.003134543 0.004052830 0.004537923 0.004962344 0.006275577 0.007420588 0.008175784 0.010970191 0.011655964 0.012462657 0.017663278 0.018734794 0.020450594 0.024222856 0.024430936 0.028669198 0.029608082 0.032475205 0.034495294 0.035637476 0.037191072 0.038742748 0.039555881 0.040562688 0.046544630 0.047339875 0.049906073 0.051666940 0.052173816 0.053226638 0.053753446 0.054548199 0.057588955 0.060129241 0.063624796 0.065433229 0.066356740 0.068266791 0.072824424 0.075689520 0.076006631 0.076925182 0.077601357 0.080022030 0.081489358 0.084982428 0.089883173 0.092334197 0.099045472 0.102406087 0.108531966 0.111368162 0.112305867 0.113868335 0.115438123 0.117428199 0.121378308 0.128740681 0.132753073 0.137159448 0.139698782 0.142046621 0.148584051 0.150241167 0.154390979 0.159242253 0.167299477 0.176371791 0.185188696 0.187754107 0.197635776 0.199144659 0.204881184 0.216628942 0.223173917 0.229642105 0.259489412 0.273168737 0.298466767 0.318777782 0.349167472 0.380114507 0.401583335 0.465976188 0.477917889 0.538505400 0.554622823 0.586760294 0.608113102 0.610415403 0.629956475 0.709167336 0.752380198 0.754898077 0.767128287 0.769897643 0.777494462 0.779971554 0.781068783 0.792294449 0.795260014 0.798274792 0.810636140 0.821150984 0.823725909 0.825859499 0.841947143 0.850347235 0.854817522 0.868575509 0.877971418 0.902013005 0.902596127 0.905435957 0.919748515 0.924298724 0.928675478 0.934656899 1.047773758 1.166923662 1.334066991 6 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1651,-1.3394,1.1315;-4.9363,-2.4155,1.0294;-4.2084,-.7892,1.1029;-5.7443,-1.0331,.2438;-5.9461,-1.0656,2.4158;-6.941,-1.5393,2.3396;-6.1325,.0211,2.5095;-5.2698,-1.5777,3.6899;-5.1222,-2.6693,3.6269;-5.9472,-1.4101,4.547;-3.9209,-.9151,3.9836;-4.0149,.1848,4.0016;-3.2035,-1.1506,3.1743;-3.2818,-1.3823,5.2644;-1.6163,-.9492,7.1254;-.9588,-1.6443,6.5727;-2.0171,-1.5467,7.9668;-.7992,.2284,7.6612;-1.4851,.9871,8.0813;-.2774,.7239,6.8198;.2182,-.1551,8.7374;-.3188,-.5809,9.6075;.7117,.7655,9.1021;1.2925,-1.1431,8.2796;1.778,-.7522,7.365;.8218,-2.1005,7.9923;2.3508,-1.4077,9.3477;1.8941,-1.8219,10.2645;3.1081,-2.1287,8.9949;2.8765,-.4773,9.6285;-3.3562,-2.6442,5.5376;-3.7288,-2.6759,6.5971;-2.7375,-.5072,6.2052;-2.7552,.5539,5.9303;-4.428,2.4873,9.3605;-5.2319,2.2382,10.0757;-4.5614,3.5392,9.056;-3.4667,2.4121,9.8996;-4.4514,1.5534,8.1532;-5.4092,1.6703,7.6124;-3.66,1.8561,7.4462;-4.2678,.0908,8.5442;-5.0465,-.1883,9.2816;-3.3063,-.0766,9.0596;-4.4282,-.9236,7.4325;-4.2514,-2.1526,7.7003;-5.2163,-.6496,6.6961; -739.263764672146 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000288570315 0.000057330686 0.031237721287 0.008400167713 0.000300000000 0.000200000000 0.001559411960 0.001039607973 -0.078348679 0.000047963 0.000063377 0.000155256 0.000208411 0.000259049 0.000438773 0.000640350 0.000871267 0.000972263 0.001157453 0.001640280 0.002867456 0.002959799 0.003134835 0.004053425 0.004543910 0.004962631 0.006275801 0.007420851 0.008177594 0.010971081 0.011657700 0.012462768 0.017663303 0.018734689 0.020450475 0.024225102 0.024433739 0.028669308 0.029608059 0.032475246 0.034495612 0.035637627 0.037190987 0.038742723 0.039555941 0.040562758 0.046545052 0.047341978 0.049907659 0.051666279 0.052174271 0.053226607 0.053754037 0.054548339 0.057588978 0.060129209 0.063624855 0.065432972 0.066356445 0.068266785 0.072824836 0.075689330 0.076007148 0.076926178 0.077602967 0.080022068 0.081490094 0.084983614 0.089883797 0.092334106 0.099045510 0.102406572 0.108531874 0.111368103 0.112305849 0.113868173 0.115439289 0.117428461 0.121379753 0.128741017 0.132754181 0.137159655 0.139698840 0.142048486 0.148585376 0.150241165 0.154391455 0.159242016 0.167299485 0.176371759 0.185188935 0.187754419 0.197637145 0.199145632 0.204880886 0.216628478 0.223172276 0.229653789 0.259490850 0.273168163 0.298466595 0.318780301 0.349167500 0.380115433 0.401583446 0.465978251 0.477919144 0.538506085 0.554622816 0.586760262 0.608113185 0.610415405 0.629957007 0.709171895 0.752380222 0.754898156 0.767128291 0.769898240 0.777494733 0.779971572 0.781068781 0.792294791 0.795260031 0.798274859 0.810636675 0.821150976 0.823725797 0.825859787 0.841947545 0.850347217 0.854817893 0.868575705 0.877971597 0.902016811 0.902596830 0.905437345 0.919748400 0.924298914 0.928676437 0.934659712 1.047773793 1.166931967 1.334067035 7 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1721,-1.3398,1.1283;-4.9428,-2.4157,1.025;-4.2158,-.7889,1.0977;-5.7538,-1.0335,.2422;-5.9501,-1.0672,2.4147;-6.945,-1.5417,2.3408;-6.1372,.0193,2.5094;-5.2704,-1.5795,3.6869;-5.1224,-2.671,3.623;-5.9459,-1.4127,4.5457;-3.9211,-.9163,3.9776;-4.0154,.1836,3.9951;-3.2051,-1.1522,3.1672;-3.2802,-1.3827,5.2578;-1.6168,-.9468,7.1203;-.9596,-1.6438,6.5703;-2.0173,-1.5409,7.9636;-.7996,.232,7.6516;-1.4856,.9949,8.0633;-.2738,.7207,6.8093;.2124,-.1462,8.7346;-.3292,-.5645,9.6052;.7061,.7755,9.0949;1.2864,-1.1398,8.2888;1.777,-.7563,7.3742;.8148,-2.0977,8.0058;2.3388,-1.4,9.3637;1.8768,-1.8071,10.2806;3.0963,-2.1248,9.0196;2.8648,-.4692,9.641;-3.3522,-2.6448,5.531;-3.7267,-2.6767,6.5903;-2.7381,-.5069,6.199;-2.7577,.5541,5.9243;-4.4044,2.4786,9.3701;-5.2007,2.2291,10.0939;-4.538,3.5323,9.0718;-3.4367,2.3976,9.8975;-4.4452,1.5495,8.1589;-5.4084,1.673,7.6287;-3.6597,1.8514,7.4448;-4.2637,.0846,8.5425;-5.0409,-.1964,9.2806;-3.3013,-.0871,9.0548;-4.4283,-.9249,7.4267;-4.2537,-2.1553,7.6902;-5.2163,-.6465,6.6917; -739.263763202811 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000730805803 0.000138003092 0.026831249842 0.008429404278 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.078351566 -0.000059015 0.000062644 0.000169877 0.000220708 0.000309212 0.000437499 0.000642648 0.000910912 0.000979206 0.001247801 0.001640338 0.002867724 0.002960088 0.003135369 0.004055271 0.004561655 0.004963997 0.006275681 0.007423232 0.008182150 0.010971710 0.011660766 0.012462692 0.017663288 0.018735911 0.020450591 0.024227094 0.024435537 0.028669618 0.029608107 0.032475231 0.034496521 0.035638145 0.037191164 0.038742718 0.039556301 0.040562759 0.046545548 0.047345543 0.049908658 0.051666078 0.052178077 0.053226923 0.053755358 0.054549998 0.057588930 0.060129112 0.063625712 0.065432749 0.066358966 0.068267160 0.072824684 0.075690232 0.076008515 0.076930489 0.077602326 0.080022589 0.081490398 0.084986130 0.089887360 0.092334576 0.099045572 0.102408150 0.108531962 0.111368169 0.112305922 0.113868516 0.115440704 0.117428696 0.121380324 0.128741170 0.132754685 0.137159923 0.139700958 0.142048511 0.148586255 0.150242647 0.154392912 0.159243841 0.167299451 0.176372658 0.185191025 0.187754551 0.197639790 0.199145874 0.204882666 0.216658183 0.223180726 0.229735573 0.259492546 0.273179291 0.298466891 0.318782080 0.349167578 0.380124869 0.401583451 0.465982271 0.477919877 0.538514709 0.554624662 0.586761660 0.608113259 0.610418191 0.629961642 0.709176224 0.752380318 0.754898478 0.767128428 0.769898250 0.777494738 0.779973105 0.781068779 0.792295209 0.795260191 0.798280957 0.810647398 0.821151163 0.823730310 0.825860143 0.841947585 0.850350592 0.854824454 0.868575747 0.877976963 0.902018387 0.902597240 0.905462496 0.919757078 0.924303173 0.928676469 0.934667886 1.047773851 1.166936173 1.334070246 8 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1872,-1.3406,1.128;-4.9583,-2.4164,1.0237;-4.2311,-.7895,1.0934;-5.7726,-1.0342,.2442;-5.9601,-1.068,2.4175;-6.9551,-1.5428,2.3477;-6.147,.0185,2.5128;-5.275,-1.5799,3.687;-5.1267,-2.6714,3.6226;-5.9471,-1.4134,4.5485;-3.9248,-.9161,3.9723;-4.0195,.1838,3.9901;-3.2119,-1.1517,3.159;-3.2784,-1.3823,5.2499;-1.6073,-.9456,7.1055;-.9442,-1.6318,6.5479;-2.0032,-1.5521,7.943;-.799,.2354,7.6488;-1.4913,.9937,8.0591;-.268,.7304,6.8125;.2054,-.1433,8.7388;-.3428,-.5639,9.6048;.6957,.7787,9.1047;1.2837,-1.1354,8.2995;1.7825,-.7495,7.3897;.8145,-2.0932,8.01;2.3266,-1.3974,9.3835;1.856,-1.8069,10.2956;3.0874,-2.1213,9.0444;2.85,-.4667,9.6679;-3.3484,-2.6446,5.5225;-3.7195,-2.6775,6.5828;-2.7328,-.5063,6.1892;-2.7542,.5548,5.9149;-4.3944,2.4741,9.3689;-5.1919,2.2237,10.0898;-4.5263,3.5281,9.0716;-3.4292,2.3922,9.8983;-4.4325,1.5471,8.1579;-5.3936,1.6709,7.6262;-3.6463,1.8503,7.4462;-4.2521,.082,8.5403;-5.0296,-.199,9.2781;-3.2901,-.0906,9.0526;-4.418,-.9268,7.4244;-4.2408,-2.157,7.6868;-5.2089,-.6492,6.6925; -739.263759443838 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000929341988 0.000201911046 0.026643571388 0.008507297710 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.078351730 -0.000125552 0.000063309 0.000169292 0.000218923 0.000335883 0.000519861 0.000645439 0.000920907 0.000980678 0.001384635 0.001640926 0.002868328 0.002960673 0.003136931 0.004059053 0.004586910 0.004964035 0.006276193 0.007429864 0.008182156 0.010973905 0.011664163 0.012464975 0.017663294 0.018739662 0.020455312 0.024229638 0.024436453 0.028669718 0.029608316 0.032475206 0.034497114 0.035638956 0.037191097 0.038742728 0.039557170 0.040562769 0.046546043 0.047349324 0.049911468 0.051675452 0.052179962 0.053226660 0.053757391 0.054553726 0.057588674 0.060130113 0.063627314 0.065433949 0.066366568 0.068268382 0.072826853 0.075689991 0.076012881 0.076944665 0.077603622 0.080024025 0.081490534 0.084996984 0.089893976 0.092335866 0.099045774 0.102411212 0.108532152 0.111368660 0.112306433 0.113872734 0.115441448 0.117428662 0.121380257 0.128742183 0.132757073 0.137159889 0.139711623 0.142049664 0.148587154 0.150243970 0.154393805 0.159244422 0.167299431 0.176374261 0.185193011 0.187761536 0.197656273 0.199146403 0.204904800 0.216753943 0.223246970 0.229895457 0.259492995 0.273257085 0.298466735 0.318785600 0.349168207 0.380174835 0.401592453 0.465986930 0.477929306 0.538522526 0.554626717 0.586764399 0.608113464 0.610429375 0.629967722 0.709193978 0.752380549 0.754899231 0.767128707 0.769898409 0.777494739 0.779981430 0.781068891 0.792295954 0.795260190 0.798281589 0.810656537 0.821151217 0.823730477 0.825865108 0.841947819 0.850372120 0.854859142 0.868576224 0.877984093 0.902027450 0.902598503 0.905494921 0.919768024 0.924310323 0.928678935 0.934698971 1.047774068 1.166950356 1.334073051 9 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.2009,-1.3356,1.1299;-4.9745,-2.4116,1.0224;-4.2441,-.7862,1.0912;-5.7907,-1.0266,.25;-5.966,-1.0641,2.4243;-6.962,-1.5376,2.3595;-6.1513,.0224,2.5224;-5.2743,-1.5786,3.6892;-5.1272,-2.6701,3.6223;-5.9418,-1.4129,4.5544;-3.922,-.9162,3.9684;-4.0155,.1837,3.9862;-3.2129,-1.1532,3.1522;-3.2717,-1.3828,5.244;-1.6024,-.9438,7.1016;-.9392,-1.6313,6.5467;-1.9989,-1.5474,7.94;-.7947,.2375,7.6428;-1.4873,.9992,8.0456;-.259,.7274,6.8072;.2033,-.1384,8.7396;-.3501,-.5543,9.6043;.6931,.784,9.1043;1.282,-1.1344,8.3105;1.7872,-.7524,7.4028;.8126,-2.0917,8.0212;2.3175,-1.3956,9.4016;1.8406,-1.8017,10.3117;3.079,-2.1219,9.0693;2.8409,-.4654,9.6866;-3.3392,-2.6453,5.5157;-3.7107,-2.6793,6.5769;-2.7275,-.5065,6.1838;-2.7506,.5547,5.91;-4.3826,2.4693,9.3644;-5.1653,2.2158,10.1033;-4.5267,3.5221,9.0686;-3.4043,2.3927,9.8744;-4.4403,1.5408,8.1526;-5.4128,1.6616,7.6377;-3.6664,1.8449,7.4255;-4.2485,.0768,8.5334;-5.0204,-.2093,9.2753;-3.2828,-.0901,9.0405;-4.4126,-.9316,7.4171;-4.2327,-2.1617,7.6787;-5.204,-.6556,6.6851; -739.263754218085 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001391618647 0.000302034206 0.029037010181 0.008452916820 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.078353031 -0.000267038 0.000065809 0.000191533 0.000222554 0.000335434 0.000605201 0.000816003 0.000920098 0.000980555 0.001431182 0.001640343 0.002868081 0.002962654 0.003140540 0.004058336 0.004581652 0.004966948 0.006282454 0.007434343 0.008182785 0.010974087 0.011663458 0.012467690 0.017663843 0.018741515 0.020457532 0.024232114 0.024436386 0.028670562 0.029608550 0.032475185 0.034497253 0.035639095 0.037191091 0.038742728 0.039557534 0.040562878 0.046546356 0.047352031 0.049911280 0.051675143 0.052180841 0.053226463 0.053757176 0.054557653 0.057588823 0.060131144 0.063627542 0.065447280 0.066378799 0.068270486 0.072833448 0.075690158 0.076013593 0.076958998 0.077631451 0.080027120 0.081490490 0.085004831 0.089903839 0.092340632 0.099045754 0.102413289 0.108532122 0.111369427 0.112307231 0.113884397 0.115441466 0.117435884 0.121383717 0.128742239 0.132756947 0.137159820 0.139724072 0.142062487 0.148587074 0.150246204 0.154400861 0.159244419 0.167299928 0.176374286 0.185193098 0.187789540 0.197668139 0.199151706 0.204983336 0.216837576 0.223497823 0.229934029 0.259496913 0.273336238 0.298476011 0.318830181 0.349168970 0.380335864 0.401599000 0.465994988 0.477929200 0.538524921 0.554642033 0.586769975 0.608115510 0.610455449 0.629973151 0.709196809 0.752380609 0.754899201 0.767129093 0.769904972 0.777494749 0.779989470 0.781068907 0.792310399 0.795260274 0.798281896 0.810657776 0.821151318 0.823730731 0.825873953 0.841947944 0.850410572 0.854936236 0.868577809 0.877984971 0.902139651 0.902623730 0.905546660 0.919768861 0.924317094 0.928680384 0.934710355 1.047774813 1.166956428 1.334073261 10 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.2168,-1.328,1.1323;-4.9909,-2.4036,1.0193;-4.2602,-.7783,1.0901;-5.8119,-1.0156,.2571;-5.9744,-1.0616,2.4323;-6.9705,-1.5355,2.3719;-6.1597,.0245,2.5353;-5.2746,-1.5799,3.6912;-5.1272,-2.6711,3.62;-5.9373,-1.4176,4.5608;-3.9211,-.9173,3.9646;-4.0147,.1826,3.9826;-3.2153,-1.1545,3.1456;-3.2663,-1.3837,5.2381;-1.5956,-.9425,7.0942;-.9333,-1.6314,6.54;-1.9906,-1.5446,7.9345;-.7871,.2402,7.6316;-1.4791,1.0067,8.026;-.2459,.7228,6.7952;.2042,-.1313,8.736;-.3553,-.5368,9.6017;.6968,.7918,9.0948;1.28,-1.1364,8.321;1.792,-.7648,7.413;.807,-2.0935,8.0372;2.308,-1.394,9.4201;1.824,-1.79,10.3308;3.0678,-2.127,9.0984;2.8343,-.4642,9.7003;-3.3302,-2.6466,5.5085;-3.7007,-2.6824,6.5705;-2.7223,-.507,6.1775;-2.7487,.5544,5.9049;-4.3874,2.4639,9.3611;-5.1777,2.2095,10.0873;-4.5267,3.5176,9.0654;-3.4182,2.3867,9.8828;-4.4308,1.5367,8.1507;-5.3966,1.6557,7.627;-3.6524,1.844,7.4329;-4.2399,.0721,8.5308;-5.0122,-.2146,9.2719;-3.2743,-.0956,9.0382;-4.4049,-.9355,7.4135;-4.2232,-2.1658,7.6734;-5.1978,-.6592,6.6832; -739.263749217493 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001276657314 0.000286525282 0.032058025025 0.008444184767 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.078351662 -0.000180063 0.000068335 0.000168100 0.000221788 0.000335887 0.000613619 0.000919600 0.000978048 0.001015178 0.001420279 0.001642606 0.002869950 0.002964640 0.003143088 0.004067335 0.004596446 0.004979798 0.006283591 0.007433937 0.008196758 0.010973941 0.011663989 0.012468831 0.017663898 0.018740856 0.020459863 0.024232749 0.024437060 0.028676878 0.029608661 0.032475153 0.034497418 0.035639786 0.037190993 0.038743014 0.039557549 0.040562867 0.046546279 0.047351813 0.049911238 0.051677714 0.052181048 0.053226039 0.053757961 0.054557005 0.057590309 0.060132852 0.063628020 0.065480221 0.066385785 0.068270185 0.072837730 0.075690581 0.076013692 0.076966803 0.077685391 0.080028313 0.081491293 0.085014352 0.089911474 0.092349262 0.099046036 0.102413908 0.108532263 0.111372721 0.112309062 0.113893648 0.115443020 0.117450707 0.121393084 0.128742738 0.132756960 0.137160469 0.139735495 0.142076692 0.148589156 0.150246795 0.154412629 0.159249454 0.167300143 0.176374475 0.185193742 0.187835622 0.197670415 0.199153859 0.205093802 0.216931251 0.223834802 0.229934301 0.259512059 0.273470337 0.298478324 0.318857795 0.349174170 0.380574028 0.401627390 0.465994732 0.477929571 0.538525107 0.554658142 0.586769848 0.608116441 0.610476364 0.629975857 0.709197587 0.752380713 0.754899601 0.767129371 0.769914723 0.777495929 0.779991673 0.781068904 0.792327180 0.795260393 0.798290564 0.810659395 0.821151787 0.823734971 0.825889343 0.841948641 0.850466650 0.855038254 0.868578203 0.877985380 0.902345918 0.902711592 0.905547829 0.919769718 0.924328201 0.928681379 0.934729472 1.047776936 1.166958058 1.334074004 11 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1993,-1.3336,1.1307;-4.9718,-2.4093,1.0221;-4.2428,-.7833,1.0931;-5.7888,-1.024,.2509;-5.9653,-1.0642,2.425;-6.9608,-1.5385,2.3591;-6.1514,.0221,2.5242;-5.2738,-1.5796,3.6895;-5.126,-2.6709,3.6216;-5.9417,-1.4152,4.5546;-3.922,-.9166,3.9698;-4.0161,.1833,3.9879;-3.2122,-1.1529,3.1541;-3.2723,-1.3831,5.2457;-1.6028,-.9443,7.1029;-.941,-1.6337,6.5484;-1.9992,-1.5464,7.9427;-.7929,.237,7.6414;-1.484,1,8.0443;-.2578,.7251,6.8042;.2063,-.1383,8.7372;-.3463,-.5515,9.6036;.6982,.7841,9.0989;1.2826,-1.1369,8.3083;1.7865,-.7581,7.3988;.8112,-2.0943,8.0224;2.3197,-1.3969,9.398;1.844,-1.7997,10.31;3.0794,-2.1253,9.0663;2.8451,-.4667,9.6795;-3.3397,-2.6456,5.5173;-3.7108,-2.6799,6.5785;-2.728,-.5068,6.1854;-2.7514,.5544,5.9118;-4.3928,2.4704,9.3638;-5.1841,2.2177,10.0912;-4.5313,3.5237,9.0667;-3.4227,2.3927,9.8858;-4.4368,1.542,8.1532;-5.4026,1.6622,7.6283;-3.6565,1.8471,7.4352;-4.2485,.0777,8.5353;-5.0223,-.2068,9.2756;-3.2839,-.0906,9.0444;-4.413,-.9312,7.4193;-4.2333,-2.1613,7.6811;-5.2044,-.655,6.6873; -739.263761014662 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000303242858 0.000061760732 0.029429378763 0.008489812151 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.078338908 -0.000107889 0.000089884 0.000116812 0.000219852 0.000337024 0.000611009 0.000882273 0.000937513 0.000986762 0.001381443 0.001642739 0.002870764 0.002965135 0.003142759 0.004068038 0.004597125 0.004983756 0.006280266 0.007432515 0.008202969 0.010974013 0.011663155 0.012469889 0.017663926 0.018740811 0.020462404 0.024233677 0.024436912 0.028679845 0.029608748 0.032475208 0.034497247 0.035639522 0.037190893 0.038743112 0.039557267 0.040562739 0.046546177 0.047351108 0.049911470 0.051679911 0.052181060 0.053226155 0.053758005 0.054555402 0.057590444 0.060135658 0.063627821 0.065500072 0.066387138 0.068269839 0.072839147 0.075690519 0.076014477 0.076971769 0.077713500 0.080028768 0.081491452 0.085023973 0.089916373 0.092353132 0.099045993 0.102414378 0.108532016 0.111374446 0.112309902 0.113899910 0.115443106 0.117456564 0.121394990 0.128743075 0.132756990 0.137161168 0.139741369 0.142083575 0.148589486 0.150245856 0.154414462 0.159251096 0.167300397 0.176374956 0.185193631 0.187858837 0.197671134 0.199154026 0.205148966 0.216971983 0.224056859 0.229941436 0.259530020 0.273552038 0.298483690 0.318865268 0.349176901 0.380677485 0.401649698 0.466002741 0.477929519 0.538527970 0.554663825 0.586769881 0.608116663 0.610484059 0.629977873 0.709197642 0.752380771 0.754899775 0.767129494 0.769918284 0.777496244 0.779992496 0.781068913 0.792333175 0.795260579 0.798297144 0.810663777 0.821152265 0.823738561 0.825894532 0.841948865 0.850489269 0.855080839 0.868578513 0.877985907 0.902394150 0.902769822 0.905548445 0.919770616 0.924338801 0.928682081 0.934738420 1.047777319 1.166959641 1.334074566 12 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1919,-1.3198,1.1341;-4.9552,-2.3929,1.0178;-4.24,-.7611,1.1029;-5.7819,-1.0084,.2552;-5.9634,-1.0665,2.4286;-6.9554,-1.5475,2.3566;-6.1578,.0178,2.5358;-5.2711,-1.5867,3.6907;-5.1179,-2.677,3.6163;-5.9408,-1.431,4.5562;-3.9229,-.9187,3.9764;-4.0217,.1809,3.9969;-3.21,-1.1495,3.1617;-3.2738,-1.3849,5.2525;-1.6018,-.9458,7.1071;-.9428,-1.6382,6.5527;-1.9978,-1.5451,7.9494;-.788,.2351,7.6409;-1.4769,.9995,8.0456;-.2554,.7212,6.8008;.215,-.1404,8.7332;-.3352,-.5473,9.6041;.7131,.7813,9.0885;1.2843,-1.1461,8.3033;1.7847,-.7747,7.3886;.8069,-2.1029,8.0255;2.3266,-1.4049,9.3884;1.8541,-1.7992,10.3059;3.0802,-2.1397,9.0568;2.8589,-.4759,9.6606;-3.3422,-2.6472,5.5255;-3.7097,-2.6804,6.5874;-2.7277,-.508,6.1907;-2.7507,.553,5.9164;-4.4164,2.4784,9.3557;-5.2135,2.2242,10.0775;-4.558,3.5296,9.0529;-3.4501,2.4078,9.8873;-4.4436,1.5452,8.1477;-5.406,1.6579,7.6138;-3.6585,1.8521,7.435;-4.25,.0836,8.5369;-5.023,-.1999,9.2786;-3.2848,-.0789,9.0466;-4.4118,-.9308,7.4256;-4.2295,-2.1594,7.6919;-5.2041,-.6594,6.6928; -739.263760760997 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000513225145 0.000122200610 0.031648191647 0.008431348715 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.078339569 -0.000032452 0.000079285 0.000176727 0.000231611 0.000339344 0.000613068 0.000882225 0.000938038 0.000987102 0.001394126 0.001644028 0.002871282 0.002965120 0.003142755 0.004069210 0.004607710 0.004987113 0.006280352 0.007432812 0.008205802 0.010974792 0.011663815 0.012469878 0.017664047 0.018740999 0.020462559 0.024233753 0.024437107 0.028681866 0.029608770 0.032475231 0.034497337 0.035639691 0.037190980 0.038743464 0.039557300 0.040562776 0.046546199 0.047351316 0.049911710 0.051681309 0.052181388 0.053226379 0.053758154 0.054555422 0.057590973 0.060136145 0.063628688 0.065502731 0.066387807 0.068270013 0.072839237 0.075691121 0.076014763 0.076972730 0.077721312 0.080032840 0.081491485 0.085024093 0.089916485 0.092355003 0.099046054 0.102414475 0.108531853 0.111374624 0.112310518 0.113901293 0.115443194 0.117459938 0.121395492 0.128744169 0.132757435 0.137161241 0.139741681 0.142085273 0.148589577 0.150245839 0.154422429 0.159251281 0.167300539 0.176375439 0.185193701 0.187865236 0.197672993 0.199154039 0.205175562 0.216973768 0.224106305 0.229946830 0.259542050 0.273556146 0.298483982 0.318875941 0.349178979 0.380703322 0.401658758 0.466002739 0.477929812 0.538528343 0.554667847 0.586770356 0.608116723 0.610484592 0.629978122 0.709202073 0.752380808 0.754899830 0.767129508 0.769922327 0.777496241 0.779993133 0.781069435 0.792340490 0.795264220 0.798297398 0.810664539 0.821152287 0.823738691 0.825896199 0.841950035 0.850492866 0.855099200 0.868579595 0.877986564 0.902408135 0.902806213 0.905562042 0.919771029 0.924345930 0.928681965 0.934740376 1.047782226 1.166963204 1.334079278 13 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1787,-1.3242,1.1325;-4.9411,-2.3972,1.019;-4.2269,-.7654,1.1044;-5.7652,-1.0146,.2507;-5.9554,-1.0692,2.4234;-6.9468,-1.5505,2.3479;-6.1503,.015,2.5284;-5.2682,-1.5874,3.6892;-5.1144,-2.6776,3.6166;-5.9415,-1.4311,4.5517;-3.9215,-.9189,3.9801;-4.0208,.1806,4.0006;-3.2053,-1.1491,3.1682;-3.2774,-1.3852,5.2588;-1.612,-.9479,7.1194;-.9546,-1.6446,6.5691;-2.0124,-1.5425,7.9626;-.7951,.2311,7.6514;-1.4815,.9944,8.0623;-.2678,.7197,6.8096;.2151,-.1477,8.736;-.3283,-.5658,9.6059;.7092,.7739,9.0972;1.289,-1.1423,8.2913;1.7826,-.7583,7.378;.8166,-2.0996,8.006;2.3385,-1.4049,9.3687;1.8734,-1.8128,10.2842;3.0959,-2.1303,9.0252;2.8653,-.4748,9.6487;-3.3488,-2.6471,5.5326;-3.7217,-2.6787,6.5931;-2.7338,-.5087,6.1984;-2.7538,.5522,5.923;-4.4143,2.4837,9.3567;-5.2124,2.2341,10.0776;-4.5507,3.5356,9.0534;-3.4492,2.4094,9.8885;-4.4467,1.5496,8.15;-5.4081,1.6667,7.616;-3.6603,1.852,7.4377;-4.261,.0868,8.5393;-5.0373,-.1939,9.2786;-3.2979,-.0803,9.0518;-4.4233,-.9266,7.4268;-4.2464,-2.1559,7.6935;-5.2121,-.6519,6.6911; -739.263764211581 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000322434545 0.000092150892 0.027445237784 0.008390375329 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.078333013 0.000037980 0.000063278 0.000173905 0.000241693 0.000376587 0.000616437 0.000882445 0.000934188 0.000984678 0.001408951 0.001642947 0.002871477 0.002965202 0.003143101 0.004070330 0.004629690 0.004997763 0.006280581 0.007434098 0.008213131 0.010978262 0.011665274 0.012470075 0.017664284 0.018743059 0.020462829 0.024233837 0.024437475 0.028687665 0.029608757 0.032475260 0.034497843 0.035639889 0.037191239 0.038744582 0.039557404 0.040562832 0.046546470 0.047352549 0.049912018 0.051681562 0.052185120 0.053226444 0.053758553 0.054556273 0.057591274 0.060138049 0.063629336 0.065502012 0.066385941 0.068270234 0.072841863 0.075693543 0.076015349 0.076976719 0.077727133 0.080034068 0.081493716 0.085026636 0.089916474 0.092358750 0.099046109 0.102415090 0.108531765 0.111374325 0.112310022 0.113901452 0.115443474 0.117462135 0.121395936 0.128744321 0.132757952 0.137162313 0.139741663 0.142085368 0.148589961 0.150246224 0.154427591 0.159252764 0.167300344 0.176375227 0.185193925 0.187869558 0.197681844 0.199157569 0.205190474 0.216996089 0.224103087 0.229959115 0.259542069 0.273583845 0.298503878 0.318873439 0.349183442 0.380713860 0.401665660 0.466006537 0.477931225 0.538528426 0.554671108 0.586775699 0.608116805 0.610484500 0.629984404 0.709209397 0.752380823 0.754901209 0.767129831 0.769924141 0.777497512 0.779995367 0.781069381 0.792345049 0.795264112 0.798298116 0.810664265 0.821152513 0.823739292 0.825896549 0.841950073 0.850494974 0.855110675 0.868579768 0.877998302 0.902411224 0.902814497 0.905566753 0.919777831 0.924354131 0.928682033 0.934742487 1.047782133 1.166988560 1.334081188 14 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1642,-1.3374,1.1299;-4.9338,-2.4128,1.0259;-4.2084,-.7857,1.1027;-5.7435,-1.0305,.2424;-5.946,-1.0668,2.4144;-6.9402,-1.5417,2.3369;-6.1339,.0194,2.5099;-5.2695,-1.5801,3.6879;-5.1211,-2.6715,3.6233;-5.9471,-1.4143,4.5451;-3.9212,-.9168,3.9826;-4.0159,.183,4.0008;-3.2032,-1.1516,3.1737;-3.2827,-1.3838,5.2637;-1.618,-.9499,7.1252;-.9595,-1.6443,6.5727;-2.0187,-1.548,7.9663;-.8022,.2285,7.6613;-1.489,.987,8.0805;-.2804,.724,6.8198;.2151,-.1534,8.738;-.3217,-.5775,9.609;.7086,.7678,9.1009;1.2893,-1.1424,8.282;1.7727,-.7546,7.3652;.8188,-2.101,7.9992;2.3496,-1.4027,9.3489;1.895,-1.8132,10.2681;3.1065,-2.1249,8.9977;2.8754,-.4712,9.6247;-3.357,-2.6456,5.5372;-3.7306,-2.6769,6.5965;-2.7388,-.5083,6.2044;-2.7565,.5526,5.9292;-4.4167,2.4857,9.3627;-5.2163,2.2378,10.0833;-4.5496,3.5381,9.06;-3.4517,2.4076,9.8952;-4.45,1.5528,8.1548;-5.4103,1.6734,7.6192;-3.6613,1.8533,7.4438;-4.2691,.0895,8.5442;-5.0486,-.189,9.281;-3.3083,-.08,9.0599;-4.4307,-.9238,7.4317;-4.2552,-2.1532,7.6987;-5.218,-.6485,6.6949; -739.263764706547 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000257807450 0.000083819917 0.028430768939 0.008056585021 0.000300000000 0.000200000000 0.001745488738 0.001163659159 -0.078342419 -0.000014377 0.000060583 0.000166934 0.000247723 0.000353727 0.000665075 0.000848132 0.000933607 0.000986133 0.001454207 0.001640969 0.002871776 0.002965997 0.003142562 0.004072036 0.004671994 0.005010484 0.006280242 0.007446907 0.008218618 0.010985393 0.011666227 0.012475520 0.017664215 0.018744595 0.020464998 0.024234110 0.024436728 0.028691874 0.029608797 0.032475053 0.034498450 0.035639897 0.037191735 0.038744837 0.039557423 0.040562953 0.046546595 0.047355815 0.049914214 0.051678702 0.052186730 0.053227196 0.053759387 0.054553318 0.057591117 0.060139165 0.063629328 0.065502684 0.066390366 0.068270289 0.072842364 0.075703665 0.076014767 0.076977090 0.077728580 0.080032146 0.081497907 0.085023984 0.089920390 0.092359459 0.099046203 0.102417909 0.108532078 0.111375234 0.112309659 0.113901627 0.115444594 0.117463738 0.121396217 0.128744548 0.132759954 0.137164224 0.139746398 0.142088961 0.148591334 0.150245936 0.154429872 0.159253684 0.167299138 0.176375771 0.185194470 0.187870725 0.197712690 0.199163641 0.205195170 0.216994810 0.224107041 0.229953609 0.259542359 0.273589232 0.298521368 0.318876544 0.349190735 0.380718077 0.401666164 0.466018453 0.477931693 0.538528570 0.554670399 0.586779652 0.608116856 0.610484559 0.629992328 0.709216291 0.752380864 0.754904259 0.767131912 0.769924328 0.777500696 0.780000305 0.781069895 0.792345374 0.795264109 0.798297872 0.810666785 0.821152363 0.823738920 0.825896228 0.841949046 0.850494973 0.855112693 0.868579992 0.878019454 0.902411763 0.902816459 0.905571783 0.919782595 0.924356792 0.928687492 0.934750346 1.047781837 1.166998559 1.334080450 15 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1501,-1.3377,1.1306;-4.916,-2.4128,1.0281;-4.1957,-.7831,1.1074;-5.7264,-1.0328,.2404;-5.9388,-1.069,2.4114;-6.9319,-1.546,2.3292;-6.1294,.017,2.5062;-5.2673,-1.5815,3.688;-5.1175,-2.6729,3.6241;-5.9489,-1.4163,4.5423;-3.9209,-.9169,3.9884;-4.0167,.1829,4.007;-3.1993,-1.1502,3.1821;-3.2866,-1.384,5.2716;-1.6256,-.9517,7.1368;-.9709,-1.6524,6.5886;-2.0299,-1.5424,7.9807;-.804,.2244,7.6671;-1.4865,.9839,8.0909;-.2871,.719,6.8226;.22,-.1602,8.7367;-.311,-.5917,9.6077;.712,.7606,9.1029;1.2959,-1.1421,8.2687;1.7753,-.7446,7.3534;.8275,-2.1001,7.979;2.3608,-1.4077,9.3302;1.9105,-1.8292,10.2471;3.1197,-2.1232,8.9693;2.8836,-.4762,9.6135;-3.364,-2.6454,5.5463;-3.7392,-2.675,6.6053;-2.7435,-.5087,6.2128;-2.7586,.552,5.9365;-4.4284,2.4926,9.3611;-5.2328,2.2467,10.0765;-4.5585,3.5447,9.0556;-3.4674,2.4149,9.9;-4.455,1.5575,8.1549;-5.4122,1.6776,7.6138;-3.6623,1.8565,7.4481;-4.2771,.0945,8.5473;-5.058,-.1816,9.2835;-3.317,-.076,9.0643;-4.4386,-.9202,7.4358;-4.2657,-2.1495,7.7046;-5.224,-.6443,6.697; -739.263762590732 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000424219481 0.000105042185 0.030748322316 0.008427661455 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.078339150 -0.000011703 0.000066201 0.000141288 0.000248130 0.000346233 0.000677113 0.000846811 0.000936745 0.000986982 0.001469126 0.001640339 0.002873260 0.002967048 0.003142551 0.004074692 0.004691308 0.005017158 0.006280725 0.007454465 0.008224216 0.010989444 0.011667569 0.012477371 0.017664602 0.018745487 0.020465271 0.024236817 0.024438039 0.028695183 0.029608865 0.032475078 0.034499180 0.035640720 0.037192130 0.038744773 0.039558354 0.040563034 0.046546956 0.047358323 0.049916011 0.051680131 0.052190121 0.053228082 0.053760889 0.054555033 0.057592604 0.060139562 0.063629364 0.065505577 0.066390729 0.068271127 0.072842889 0.075704511 0.076015121 0.076977860 0.077729141 0.080032145 0.081502962 0.085024552 0.089922489 0.092360465 0.099046554 0.102419273 0.108532298 0.111375274 0.112309830 0.113901803 0.115447461 0.117465455 0.121399641 0.128744718 0.132761636 0.137165804 0.139747052 0.142093554 0.148594187 0.150246824 0.154431538 0.159254266 0.167299229 0.176375590 0.185195254 0.187872764 0.197734223 0.199173747 0.205199517 0.217021290 0.224114224 0.229955474 0.259543944 0.273607924 0.298552849 0.318878776 0.349206882 0.380727737 0.401665623 0.466025548 0.477931710 0.538528727 0.554670696 0.586785675 0.608118067 0.610485086 0.630001004 0.709221809 0.752380962 0.754906169 0.767133768 0.769924748 0.777511807 0.780002711 0.781070544 0.792345899 0.795265584 0.798299265 0.810667485 0.821152687 0.823740944 0.825897441 0.841949431 0.850496168 0.855114487 0.868582164 0.878031768 0.902413206 0.902822661 0.905572741 0.919788946 0.924357647 0.928687867 0.934754162 1.047785007 1.167004231 1.334083908 16 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1668,-1.3382,1.1316;-4.938,-2.4142,1.0288;-4.2101,-.7878,1.1025;-5.7469,-1.0316,.2445;-5.9468,-1.0649,2.4167;-6.9419,-1.5386,2.3411;-6.1331,.0218,2.5111;-5.2695,-1.5778,3.69;-5.1225,-2.6695,3.6264;-5.9462,-1.4102,4.5477;-3.92,-.9158,3.9827;-4.0135,.1842,4.0003;-3.2032,-1.1521,3.1731;-3.2807,-1.3829,5.2634;-1.6168,-.9489,7.1258;-.9601,-1.646,6.575;-2.0181,-1.5436,7.9685;-.7985,.2288,7.6586;-1.4836,.9896,8.0759;-.2758,.7212,6.8161;.2178,-.1531,8.7363;-.3201,-.5769,9.6068;.7113,.768,9.0995;1.292,-1.1425,8.2813;1.7788,-.7532,7.3666;.821,-2.1001,7.9948;2.3488,-1.4061,9.3511;1.8907,-1.8192,10.2677;3.1064,-2.1277,9.0001;2.8742,-.4754,9.6315;-3.3547,-2.6448,5.5367;-3.7278,-2.6765,6.5965;-2.7374,-.5075,6.2044;-2.7555,.5535,5.9295;-4.4245,2.4854,9.361;-5.2263,2.2357,10.0783;-4.5588,3.5374,9.0575;-3.4618,2.41,9.8973;-4.4512,1.552,8.1535;-5.41,1.6698,7.615;-3.6612,1.8546,7.445;-4.2676,.0891,8.5434;-5.0459,-.1905,9.281;-3.3059,-.0789,9.058;-4.4287,-.9243,7.4308;-4.2525,-2.1537,7.6977;-5.2164,-.6493,6.6943; -739.263765276744 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000176716757 0.000047955161 0.017963739293 0.004576880631 0.000300000000 0.000200000000 0.002546447812 0.001697631875 -0.078348385 0.000049055 0.000063324 0.000136477 0.000248842 0.000318307 0.000645187 0.000826298 0.000932245 0.000985635 0.001447527 0.001638504 0.002874997 0.002982987 0.003142057 0.004082322 0.004745853 0.005047716 0.006280575 0.007470984 0.008247385 0.011009508 0.011669038 0.012481869 0.017664979 0.018746915 0.020466314 0.024246135 0.024444757 0.028707337 0.029608948 0.032475097 0.034502089 0.035642372 0.037194556 0.038744716 0.039560271 0.040563117 0.046547708 0.047367982 0.049923766 0.051686416 0.052195823 0.053230277 0.053764247 0.054556041 0.057592689 0.060139421 0.063629903 0.065507511 0.066392595 0.068272814 0.072844508 0.075711884 0.076016537 0.076979267 0.077732640 0.080033868 0.081515347 0.085025939 0.089927946 0.092363778 0.099047161 0.102423503 0.108532636 0.111376217 0.112310050 0.113901677 0.115455182 0.117470785 0.121407954 0.128746461 0.132768514 0.137170959 0.139748652 0.142117405 0.148597704 0.150247534 0.154433533 0.159254731 0.167299267 0.176377031 0.185196386 0.187879132 0.197792216 0.199206226 0.205220887 0.217062678 0.224124393 0.229960666 0.259548908 0.273681175 0.298626644 0.318880583 0.349251791 0.380753301 0.401671600 0.466106234 0.477936210 0.538531593 0.554673753 0.586804501 0.608121812 0.610485452 0.630024319 0.709231171 0.752381148 0.754909398 0.767138406 0.769925320 0.777541149 0.780006281 0.781071718 0.792346557 0.795267881 0.798303051 0.810669051 0.821153455 0.823747303 0.825898840 0.841951185 0.850497849 0.855122813 0.868586326 0.878070826 0.902414643 0.902829066 0.905574618 0.919808548 0.924361273 0.928688916 0.934762444 1.047794676 1.167012423 1.334091467 17 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1702,-1.3421,1.1292;-4.9429,-2.4187,1.0279;-4.2129,-.7931,1.0984;-5.7505,-1.0362,.242;-5.949,-1.0658,2.4144;-6.9446,-1.5385,2.3403;-6.1341,.0213,2.507;-5.2713,-1.5771,3.688;-5.1248,-2.669,3.6259;-5.9475,-1.408,4.5459;-3.9214,-.9154,3.9792;-4.0145,.1846,3.9965;-3.2054,-1.1522,3.169;-3.2811,-1.3824,5.2595;-1.6158,-.9479,7.1207;-.9571,-1.6417,6.5682;-2.0159,-1.5459,7.9618;-.8007,.2308,7.6567;-1.488,.9905,8.0724;-.2762,.7244,6.816;.2127,-.1501,8.7373;-.3275,-.5735,9.6066;.7051,.7713,9.1014;1.2883,-1.1398,8.286;1.7771,-.7514,7.3721;.8183,-2.0978,7.9998;2.3427,-1.4016,9.3586;1.8825,-1.8132,10.2748;3.1011,-2.1236,9.0105;2.8674,-.4705,9.6388;-3.3542,-2.6444,5.5324;-3.7274,-2.6765,6.5921;-2.7375,-.507,6.2004;-2.7563,.5541,5.9257;-4.4105,2.4812,9.3663;-5.2083,2.2317,10.0881;-4.5446,3.5341,9.0658;-3.4446,2.4027,9.8965;-4.4465,1.5504,8.157;-5.4081,1.6716,7.6241;-3.6597,1.8524,7.4446;-4.2643,.0864,8.5432;-5.042,-.1939,9.2811;-3.3022,-.0838,9.0565;-4.4275,-.9247,7.4289;-4.2518,-2.1546,7.6937;-5.2158,-.648,6.6937; -739.263765590674 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000193551644 0.000031509889 0.006223951583 0.001502207634 0.000300000000 0.000200000000 0.002324960872 0.001549973915 -0.078340422 0.000059759 0.000068863 0.000163478 0.000249378 0.000315325 0.000641783 0.000824136 0.000924732 0.000983189 0.001433353 0.001639692 0.002875283 0.002983127 0.003142457 0.004083448 0.004746587 0.005046411 0.006280898 0.007473798 0.008244740 0.011011245 0.011669050 0.012481724 0.017664787 0.018749006 0.020467258 0.024247289 0.024445640 0.028708887 0.029608940 0.032475072 0.034502017 0.035643029 0.037194590 0.038744762 0.039560535 0.040563124 0.046547988 0.047368414 0.049924164 0.051690262 0.052199277 0.053230461 0.053764396 0.054560646 0.057592567 0.060139508 0.063629583 0.065506865 0.066393021 0.068272772 0.072844993 0.075712018 0.076017484 0.076980238 0.077732257 0.080034903 0.081516844 0.085031613 0.089929691 0.092363664 0.099047231 0.102423837 0.108532764 0.111376240 0.112310126 0.113901012 0.115456046 0.117470789 0.121408684 0.128746590 0.132769060 0.137171618 0.139748775 0.142119795 0.148599165 0.150247675 0.154434137 0.159257260 0.167299681 0.176377035 0.185198470 0.187879972 0.197794118 0.199209828 0.205221552 0.217080573 0.224126041 0.229973118 0.259549830 0.273710170 0.298631091 0.318881486 0.349253736 0.380752353 0.401676801 0.466146680 0.477943643 0.538530815 0.554674737 0.586807033 0.608122589 0.610485269 0.630025891 0.709232578 0.752381125 0.754909586 0.767138532 0.769925457 0.777542465 0.780006677 0.781071802 0.792346864 0.795268514 0.798304752 0.810670421 0.821153697 0.823749909 0.825898764 0.841952071 0.850498891 0.855124623 0.868588922 0.878075370 0.902415289 0.902833229 0.905575242 0.919813160 0.924362911 0.928689006 0.934763323 1.047800117 1.167012828 1.334092143 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.1709,-1.3403,1.1304;-4.9435,-2.4167,1.0283;-4.2137,-.7912,1.0998;-5.7516,-1.0338,.2437;-5.9491,-1.0651,2.4162;-6.9447,-1.5379,2.3422;-6.1343,.0218,2.5097;-5.2708,-1.5772,3.6892;-5.1242,-2.669,3.6263;-5.9464,-1.4087,4.5474;-3.9207,-.9155,3.98;-4.0138,.1845,3.9974;-3.2049,-1.1524,3.1697;-3.2801,-1.3825,5.2601;-1.6151,-.948,7.1214;-.9569,-1.6427,6.5692;-2.0152,-1.5453,7.963;-.7992,.2306,7.6564;-1.486,.9908,8.0721;-.2748,.7236,6.8153;.2146,-.1503,8.7368;-.3254,-.5731,9.6064;.7075,.771,9.1003;1.2896,-1.1405,8.2854;1.7789,-.7522,7.3718;.819,-2.098,7.9987;2.3434,-1.4036,9.3582;1.8828,-1.8154,10.2739;3.1015,-2.1259,9.01;2.8686,-.473,9.639;-3.353,-2.6446,5.5329;-3.726,-2.6769,6.5928;-2.7367,-.5071,6.2011;-2.7557,.5539,5.9265;-4.4154,2.4822,9.3639;-5.2145,2.2325,10.0842;-4.5497,3.5348,9.0625;-3.4505,2.4048,9.8961;-4.4481,1.5505,8.1552;-5.4089,1.6702,7.6205;-3.6604,1.8529,7.444;-4.2649,.0869,8.5427;-5.0427,-.1935,9.2805;-3.3029,-.082,9.0566;-4.4269,-.9251,7.4291;-4.2504,-2.1547,7.6947;-5.2152,-.6495,6.6935; -739.263765705933 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 -895.45967379 22.10123849 25.62419603 33.49953928 40.08737376 48.89625895 62.57106850 73.01243629 87.38200909 96.70230405 112.22758609 126.33822929 183.11636010 194.64833579 205.23842130 225.94365977 246.26533126 252.45662185 263.98741725 271.05740118 272.46915333 286.54640024 308.01123055 332.65936969 366.15797105 428.27111724 437.80779158 462.00252203 521.96753996 535.51924463 567.25917388 602.36433609 731.97663832 737.35674201 753.25475091 757.55526145 782.16704223 790.38668512 818.38888160 870.33759213 874.38453207 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