# Bonding information for index 496 -- ACE_1@O 0MA_12@H6O 0MA_12@O6 # Index Sim # Frame Type Length Angle N-N dist ## Starting information for simulation # 1 ## Starting information for simulation # 2 ## Starting information for simulation # 3 496 3 30 2 2.62 2.9172 13.451 496 3 31 2 2.64 2.4185 13.237 496 3 110 2 2.66 2.8224 11.393 496 3 111 2 2.83 2.8675 11.603 496 3 175 2 2.63 2.6781 12.336 496 3 177 2 2.83 2.4660 11.752 496 3 2505 2 2.88 2.3757 11.400 496 3 2506 2 2.98 2.5995 11.895 496 3 7458 2 2.65 2.9999 10.145 496 3 9197 2 2.79 2.9599 10.706 ## Starting information for simulation # 4 ## Starting information for simulation # 5 ## Starting information for simulation # 6 ## Starting information for simulation # 7 ## Starting information for simulation # 8 ## Starting information for simulation # 9 496 9 1457 2 2.95 2.9183 11.962 496 9 2017 2 2.91 2.9902 11.973 496 9 2020 2 2.72 2.8003 12.616 ## Starting information for simulation # 10 ## Starting information for simulation # 11 ## Starting information for simulation # 12 ## Starting information for simulation # 13 ## Starting information for simulation # 14 496 14 4278 2 2.65 2.8802 8.606 496 14 5207 2 2.66 2.9999 9.150 496 14 5208 2 2.84 2.6533 9.187 496 14 5210 2 2.76 2.4437 9.161 496 14 5211 2 2.71 2.6894 8.486 496 14 5213 2 2.64 2.8559 9.166 496 14 7095 2 2.77 2.9302 7.436 496 14 7096 2 2.90 2.9674 7.691 496 14 7097 2 2.73 2.7025 7.362 496 14 7099 2 2.71 2.9719 7.548 496 14 8589 2 2.86 3.0375 6.221 496 14 9822 2 2.84 2.8260 9.380 496 14 9823 2 2.81 2.6184 9.556 496 14 9825 2 2.78 2.8703 9.191 496 14 9834 2 2.77 2.6005 9.585 496 14 9838 2 2.93 3.0268 9.422 496 14 9839 2 2.68 2.5784 9.285 ## Starting information for simulation # 15 496 15 2112 2 2.67 2.8071 8.692 496 15 2142 2 2.60 2.7002 8.535 496 15 2158 2 2.90 2.8817 8.797 496 15 2162 2 2.80 2.9861 8.462 496 15 2176 2 2.85 2.7402 7.920 496 15 3531 2 2.97 2.5740 11.384 496 15 3532 2 2.72 2.7776 11.707 496 15 3620 2 2.74 2.6354 10.602 496 15 4551 2 2.82 2.8766 12.393 496 15 4552 2 2.80 2.7415 11.967 ## Starting information for simulation # 16 ## Starting information for simulation # 17 ## Starting information for simulation # 18 ## Starting information for simulation # 19 496 19 784 2 2.75 3.0214 10.480 496 19 785 2 2.80 2.7180 10.426 496 19 789 2 2.79 2.6587 11.323 496 19 889 2 2.64 2.9496 9.410 496 19 890 2 2.77 2.4741 9.423 496 19 891 2 2.76 2.8462 9.851 496 19 892 2 2.82 2.7057 10.232 496 19 894 2 2.92 2.9964 9.762 496 19 895 2 2.65 2.9777 9.674 496 19 896 2 2.97 2.7951 9.577 496 19 897 2 2.76 2.8964 9.503 496 19 898 2 2.77 2.6218 9.881 496 19 899 2 2.89 2.8509 10.373 496 19 900 2 2.70 3.0320 9.671 496 19 1001 2 2.98 2.2294 8.594 496 19 3702 2 2.74 2.6245 12.928 496 19 3707 2 2.78 2.5663 13.285 496 19 3708 2 2.61 2.6463 13.136 496 19 3709 2 2.88 2.6044 12.548 496 19 8057 2 2.98 2.5231 11.369 496 19 8506 2 2.67 2.7279 12.285 496 19 8507 2 2.94 2.9006 11.957 496 19 8508 2 2.68 2.4869 12.491 496 19 8509 2 2.85 2.5655 11.902 496 19 8510 2 2.85 2.8523 11.906 496 19 8511 2 2.90 2.4652 11.988 496 19 8512 2 2.77 2.5159 11.974 496 19 8513 2 2.71 2.7797 11.975 496 19 8514 2 2.88 2.3087 11.811 496 19 8515 2 2.97 2.5808 11.697 496 19 8516 2 2.75 2.5046 12.021 496 19 8517 2 2.94 3.0049 11.947 496 19 8518 2 2.66 3.0927 11.970 496 19 8528 2 2.69 2.7743 11.474 ## Starting information for simulation # 20 496 20 1210 2 2.97 3.0380 10.347 496 20 1212 2 2.77 2.9553 9.892 496 20 2261 2 2.76 2.9103 12.080 496 20 2262 2 2.61 2.9485 12.196 496 20 2263 2 2.76 3.0295 11.848 496 20 2264 2 2.81 2.8220 11.706 496 20 2460 2 2.77 3.0592 11.688 496 20 2461 2 2.74 2.7799 11.702 496 20 6220 2 2.85 2.5979 7.879 496 20 7122 2 2.84 2.9066 6.569 496 20 7123 2 2.77 2.8898 6.327 496 20 7125 2 2.71 2.2947 6.101 496 20 7126 2 2.74 2.7256 5.692 496 20 7246 2 2.95 3.1273 6.198 496 20 7271 2 2.90 2.7628 6.295 496 20 7272 2 2.94 2.3607 6.618 496 20 7273 2 2.82 2.9055 6.410 496 20 7520 2 2.78 2.6636 5.479 496 20 7521 2 2.70 2.9439 6.148 496 20 7616 2 2.72 2.8260 6.220 496 20 7622 2 2.92 3.0139 5.879 496 20 7824 2 2.83 2.8194 6.233 496 20 7825 2 2.81 2.6900 6.358 496 20 7865 2 2.59 3.0514 5.610 496 20 8034 2 2.76 2.8149 5.214 496 20 8036 2 2.53 2.8457 5.490 496 20 8081 2 2.59 2.8648 5.388 496 20 8350 2 2.99 2.4391 6.679 496 20 8353 2 2.73 3.0629 6.370 496 20 8354 2 2.78 2.8357 6.441 496 20 8437 2 2.95 2.8908 6.751 496 20 8527 2 2.64 3.0612 9.611 496 20 8575 2 2.69 2.9493 9.068 496 20 8972 2 2.53 2.8229 9.144 496 20 8973 2 2.74 2.8517 9.151 496 20 8974 2 2.95 2.3645 9.158 496 20 8975 2 2.66 2.8427 9.076 496 20 8976 2 2.88 2.8991 8.718 496 20 9853 2 2.95 2.7683 8.792 ## Starting information for simulation # 21 ## Starting information for simulation # 22 ## Starting information for simulation # 23 496 23 2219 2 2.66 2.8270 11.212 496 23 2220 2 2.71 2.7251 11.694 496 23 2221 2 2.85 2.5583 11.792 496 23 2222 2 2.67 2.9012 11.620 496 23 8210 2 2.96 2.3078 10.573 496 23 8212 2 2.92 3.0644 10.882 496 23 8214 2 2.81 2.6029 10.845 496 23 8215 2 2.77 2.9342 11.144 496 23 8216 2 2.98 2.9178 11.105 496 23 8217 2 2.94 2.6773 11.059 496 23 8218 2 2.73 3.0489 10.616 496 23 8219 2 2.86 2.4997 10.785 ## Starting information for simulation # 24 496 24 9215 2 2.89 2.8012 12.979 496 24 9225 2 2.71 2.6255 12.975 496 24 9227 2 2.80 2.5846 13.124 496 24 9229 2 2.51 2.8246 13.336 496 24 9250 2 2.58 2.9192 13.008 496 24 9262 2 2.79 2.7682 13.090 496 24 9267 2 2.76 1.8952 12.538 ## Starting information for simulation # 25 496 25 7691 2 2.91 3.0152 12.043 496 25 8012 2 2.62 2.4616 12.090 496 25 8014 2 2.63 2.7004 12.812 496 25 8015 2 2.69 3.0834 12.128 496 25 8016 2 2.70 2.9646 11.757 496 25 8017 2 2.78 2.9536 12.678 496 25 8018 2 2.81 2.6548 11.936 496 25 8644 2 2.96 2.0288 13.065 496 25 8645 2 2.66 2.8693 12.309 496 25 9665 2 2.84 2.4236 11.952 ## Starting information for simulation # 26 ## Starting information for simulation # 27 496 27 5320 2 2.67 2.7855 11.182 496 27 5321 2 2.74 2.9628 11.544 496 27 5322 2 2.69 2.8408 11.035 496 27 5323 2 2.58 3.0045 11.293 496 27 5324 2 2.60 2.9320 11.067 496 27 6098 2 2.86 3.0157 11.441 ## Starting information for simulation # 28 ## Starting information for simulation # 29 ## Starting information for simulation # 30 ## Starting information for simulation # 31 ## Starting information for simulation # 32 ## Starting information for simulation # 33 ## Starting information for simulation # 34 ## Starting information for simulation # 35 496 35 202 2 2.83 2.4481 10.747 496 35 5995 2 2.84 2.7014 13.168 496 35 5996 2 2.81 2.7008 13.820 496 35 5998 2 2.93 1.9372 13.457 496 35 5999 2 2.90 2.4897 13.543 496 35 6000 2 2.92 2.6492 13.548 496 35 6040 2 2.77 2.4053 13.859 496 35 6041 2 2.80 2.7896 13.185 496 35 6042 2 2.72 2.8476 13.182 496 35 6043 2 2.96 2.2835 13.764 496 35 6044 2 2.78 2.7138 13.501 496 35 6045 2 2.80 2.5687 13.683 496 35 6046 2 2.83 2.7317 13.261 496 35 7573 2 2.93 2.7162 13.087 496 35 7574 2 2.76 2.8773 13.196 496 35 7575 2 2.78 2.7171 12.916 496 35 7576 2 2.70 2.4499 12.387 ## Starting information for simulation # 36