# Bonding information for index 453 -- 0MA_15@O5 0MA_14@H3O 0MA_14@O3 # Index Sim # Frame Type Length Angle N-N dist ## Starting information for simulation # 1 ## Starting information for simulation # 2 ## Starting information for simulation # 3 ## Starting information for simulation # 4 ## Starting information for simulation # 5 ## Starting information for simulation # 6 ## Starting information for simulation # 7 453 7 4295 1 2.87 2.4201 12.752 453 7 4296 1 2.74 2.8716 13.033 453 7 4297 1 2.55 2.6169 13.119 453 7 4300 1 2.86 2.7050 12.665 453 7 4325 1 2.69 2.8553 11.478 453 7 4328 1 2.79 2.6707 12.039 ## Starting information for simulation # 8 ## Starting information for simulation # 9 ## Starting information for simulation # 10 ## Starting information for simulation # 11 ## Starting information for simulation # 12 ## Starting information for simulation # 13 ## Starting information for simulation # 14 453 14 4879 1 2.99 2.9547 8.130 453 14 5047 1 2.70 2.9638 9.265 453 14 6100 1 2.86 2.8455 8.508 453 14 6101 1 2.90 2.6855 8.445 453 14 6695 1 2.71 2.4360 6.622 453 14 6700 1 2.94 2.6067 6.242 453 14 6701 1 2.71 2.6932 6.724 453 14 6706 1 2.86 2.4313 6.263 453 14 6828 1 2.59 2.9429 7.791 453 14 7395 1 2.81 2.9433 5.718 453 14 8002 1 2.69 2.6686 6.067 453 14 8075 1 2.74 2.6756 6.909 453 14 8639 1 2.99 2.3500 6.124 453 14 8656 1 2.90 2.0453 6.130 453 14 9084 1 2.90 2.7598 9.481 453 14 9086 1 2.81 2.9923 9.544 453 14 9088 1 2.97 1.7548 9.601 453 14 9493 1 2.88 2.8041 9.325 453 14 9558 1 2.94 2.2491 9.325 453 14 9560 1 2.96 2.6418 9.633 453 14 9562 1 2.96 2.5005 9.316 453 14 9569 1 2.86 2.6754 9.518 453 14 9571 1 2.83 2.2428 9.734 ## Starting information for simulation # 15 ## Starting information for simulation # 16 453 16 1918 1 2.99 2.1807 6.900 453 16 1976 1 2.95 2.7900 6.871 453 16 1977 1 2.93 2.4430 6.548 453 16 2421 1 2.91 2.6724 6.453 453 16 2652 1 2.75 2.8332 6.627 453 16 2653 1 2.86 2.3440 6.238 453 16 2654 1 2.75 2.7655 6.306 453 16 2655 1 2.87 1.9587 6.612 453 16 2677 1 2.71 2.7794 6.572 453 16 3117 1 2.98 2.2923 6.433 453 16 3120 1 2.87 2.6764 6.222 453 16 3121 1 2.80 2.7779 6.110 453 16 3122 1 2.89 2.2243 6.096 453 16 3123 1 2.92 2.6877 6.384 453 16 3304 1 2.88 2.8737 6.423 453 16 5938 1 2.87 2.2986 8.219 453 16 6555 1 2.93 2.7533 7.194 453 16 6557 1 2.77 2.3903 7.296 453 16 6558 1 2.88 2.8474 7.125 453 16 6559 1 2.83 2.1204 7.467 453 16 6560 1 2.75 3.0153 8.237 453 16 6576 1 2.95 2.7487 7.849 453 16 6577 1 2.74 2.8058 8.108 453 16 6578 1 2.93 2.1687 8.329 453 16 6585 1 2.90 2.4169 8.480 453 16 6594 1 2.79 3.1083 7.906 453 16 6641 1 2.92 2.9055 8.483 453 16 6642 1 2.87 2.4090 8.089 453 16 6645 1 2.70 2.8222 8.350 453 16 6648 1 2.66 2.8936 8.232 453 16 6685 1 2.81 2.2208 7.878 453 16 6686 1 2.57 1.7746 7.772 453 16 6687 1 2.72 2.9881 7.648 453 16 6689 1 2.86 2.7785 8.417 453 16 6690 1 2.86 2.6502 8.523 453 16 6691 1 2.65 2.8756 8.770 453 16 6695 1 2.69 2.9189 8.477 453 16 6697 1 2.80 1.9522 8.584 453 16 6777 1 2.88 2.9367 8.135 453 16 6779 1 2.72 2.6985 8.476 453 16 6781 1 2.72 3.0397 8.262 453 16 6782 1 2.98 2.5331 8.598 453 16 6783 1 2.90 2.4230 8.522 453 16 7044 1 2.77 2.8121 6.403 453 16 7045 1 2.90 2.8527 6.572 453 16 7149 1 2.94 2.8882 6.388 453 16 7151 1 2.58 2.8502 6.384 453 16 7152 1 2.76 3.0613 6.682 453 16 7157 1 2.63 2.9063 6.491 453 16 7158 1 2.90 2.2422 6.394 453 16 7489 1 2.70 2.7902 6.362 453 16 7824 1 3.00 2.1348 6.630 453 16 8171 1 2.87 3.1011 6.599 453 16 8172 1 2.95 2.8216 6.623 453 16 8614 1 2.99 2.6636 7.466 453 16 8615 1 2.72 2.3382 7.986 453 16 8832 1 2.83 2.7702 6.575 ## Starting information for simulation # 17 453 17 3915 1 2.91 3.0357 12.446 453 17 3916 1 2.68 2.9995 12.843 453 17 5570 1 2.67 2.6491 12.577 453 17 6597 1 2.88 2.7579 9.004 453 17 6667 1 2.89 2.7335 8.196 453 17 6668 1 2.95 1.9669 9.257 453 17 6669 1 2.80 2.6713 9.853 453 17 6670 1 2.72 2.4031 9.385 453 17 6671 1 2.86 2.1643 9.378 453 17 6760 1 2.91 2.8964 8.604 ## Starting information for simulation # 18 ## Starting information for simulation # 19 453 19 6167 1 2.75 2.7971 8.203 453 19 6169 1 2.80 2.4035 7.922 453 19 6570 1 2.97 2.7820 8.512 453 19 7644 1 2.63 2.9896 8.693 453 19 7650 1 2.90 2.7424 8.018 453 19 7655 1 2.88 2.6179 8.198 453 19 7679 1 2.78 2.7159 8.656 453 19 8271 1 2.88 2.2047 11.457 453 19 8696 1 2.94 2.4419 12.687 453 19 8700 1 2.69 2.9391 12.482 453 19 8706 1 2.78 2.7789 11.888 453 19 8842 1 2.88 2.7677 12.826 ## Starting information for simulation # 20 ## Starting information for simulation # 21 ## Starting information for simulation # 22 ## Starting information for simulation # 23 ## Starting information for simulation # 24 ## Starting information for simulation # 25 ## Starting information for simulation # 26 453 26 6178 1 2.92 2.7175 8.901 453 26 6187 1 2.75 2.9036 9.127 ## Starting information for simulation # 27 ## 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 ## Starting information for simulation # 36 453 36 673 1 2.97 2.6107 8.708 453 36 683 1 2.95 2.7384 8.812 453 36 684 1 2.88 2.6788 8.063 453 36 685 1 2.95 2.0458 8.521 453 36 686 1 2.91 2.5000 8.027 453 36 690 1 2.77 2.9270 8.354 453 36 691 1 3.00 1.9105 7.986 453 36 708 1 2.61 3.1201 9.270 453 36 710 1 2.74 2.8186 8.524 453 36 711 1 2.96 2.8370 8.910 453 36 890 1 2.78 2.9713 8.278 453 36 892 1 2.59 2.6474 7.598 453 36 895 1 2.91 2.1736 8.365 453 36 898 1 2.92 2.4123 8.527 453 36 1345 1 2.67 2.3436 7.797 453 36 1356 1 2.80 2.8662 8.102 453 36 1357 1 2.90 2.3327 8.238 453 36 1360 1 2.83 2.2979 8.706 453 36 1362 1 2.64 2.3015 8.559 453 36 3302 1 2.83 2.4247 9.448