# Bonding information for index 98 -- 0VA_13@O3 0VA_15@H6O 0VA_15@O6 # Index Sim # Frame Type Length Angle N-N dist ## Starting information for simulation # 1 ## Starting information for simulation # 2 98 2 849 1 2.99 2.0193 13.676 ## Starting information for simulation # 3 ## Starting information for simulation # 4 ## Starting information for simulation # 5 98 5 364 1 2.82 3.0625 13.235 98 5 367 1 2.95 2.1673 13.574 98 5 381 1 2.63 2.4445 14.372 98 5 383 1 2.86 2.3366 14.013 98 5 395 1 2.82 2.2440 13.945 98 5 2601 1 2.64 2.5354 13.877 98 5 2602 1 2.73 2.3718 14.475 98 5 2813 1 2.90 2.5476 14.235 98 5 2824 1 2.81 2.8346 14.272 98 5 2825 1 2.97 2.4005 13.349 98 5 3173 1 2.73 1.9167 12.930 98 5 3176 1 2.78 2.5366 13.296 98 5 3177 1 2.88 2.6151 13.166 98 5 3178 1 2.75 2.5329 13.239 98 5 3191 1 2.98 2.0480 12.693 98 5 3214 1 2.77 2.8506 13.446 98 5 3215 1 2.81 2.2709 13.609 98 5 3218 1 2.87 2.5261 12.840 98 5 3235 1 2.99 2.9581 13.255 98 5 3302 1 2.86 2.5351 13.567 98 5 3727 1 2.98 2.0173 12.728 98 5 3757 1 2.95 2.8000 13.183 98 5 3760 1 2.92 2.4609 13.202 98 5 3761 1 2.88 2.6342 13.147 98 5 3762 1 2.84 1.9269 12.998 98 5 3763 1 2.72 3.0047 12.845 98 5 3765 1 2.94 3.0452 12.914 98 5 8894 1 2.75 2.3837 14.287 ## Starting information for simulation # 6 ## Starting information for simulation # 7 98 7 4955 1 3.00 2.7639 13.659 ## Starting information for simulation # 8 ## Starting information for simulation # 9 ## Starting information for simulation # 10 98 10 8632 1 2.68 2.5749 12.785 98 10 8634 1 2.85 2.5985 12.723 ## Starting information for simulation # 11 ## Starting information for simulation # 12 98 12 146 1 2.81 2.9421 13.593 98 12 147 1 2.88 2.5059 13.431 98 12 152 1 2.87 2.5967 13.654 98 12 1233 1 2.90 2.9688 13.823 98 12 2400 1 2.73 2.8189 12.952 98 12 2404 1 2.89 2.8519 12.912 98 12 2405 1 2.86 2.8884 13.037 98 12 2406 1 2.78 2.9623 13.032 98 12 2419 1 2.95 2.2179 12.866 ## Starting information for simulation # 13 98 13 57 1 2.77 2.7246 13.903 98 13 80 1 2.83 3.0231 13.505 98 13 627 1 2.95 2.0165 14.068 98 13 815 1 2.78 2.6782 13.929 98 13 2126 1 2.80 2.5797 14.344 98 13 2129 1 2.75 2.8766 13.812 98 13 2135 1 2.77 2.1505 14.256 98 13 2660 1 2.88 2.2383 12.185 98 13 2661 1 2.72 2.8330 12.463 98 13 2662 1 2.81 2.5417 12.714 98 13 2669 1 2.84 2.8295 12.899 98 13 9494 1 2.69 2.9246 11.870 ## Starting information for simulation # 14 98 14 427 1 2.97 1.9566 13.919 98 14 456 1 2.73 2.5076 12.747 98 14 494 1 2.88 2.1260 13.160 98 14 496 1 2.83 2.3327 12.473 98 14 497 1 2.97 1.8474 13.092 98 14 500 1 2.88 2.9710 13.195 ## Starting information for simulation # 15 98 15 346 1 2.75 2.8497 14.007 98 15 347 1 2.87 2.9795 13.897 98 15 349 1 2.99 2.6926 14.006 98 15 354 1 2.91 2.4532 14.392 98 15 1063 1 2.87 2.8121 13.026 98 15 4635 1 2.81 2.9048 13.056 98 15 6397 1 2.88 1.9802 12.865 98 15 6747 1 2.80 1.9482 13.170 98 15 6752 1 2.81 2.7016 13.576 ## Starting information for simulation # 16 ## Starting information for simulation # 17 ## Starting information for simulation # 18 98 18 2268 1 2.83 2.7046 12.691 98 18 4595 1 2.86 2.6376 13.486 ## Starting information for simulation # 19 98 19 3782 1 2.57 2.8692 14.302 98 19 3783 1 2.83 2.8074 14.556 ## Starting information for simulation # 20 98 20 7181 1 2.89 2.4730 13.651 98 20 7182 1 2.67 3.0503 13.795 98 20 7254 1 2.80 2.8109 14.137 98 20 7279 1 2.94 2.3019 14.290 98 20 7280 1 2.73 2.8086 14.211 98 20 7281 1 2.85 2.5728 14.227 98 20 7282 1 2.73 2.9790 14.143 98 20 7283 1 2.87 2.6353 14.266 98 20 7285 1 2.98 2.1946 14.599 98 20 7288 1 2.78 2.4058 14.296 ## Starting information for simulation # 21 ## Starting information for simulation # 22 98 22 8565 1 2.80 1.7834 13.819 98 22 8585 1 2.55 2.8165 14.026 98 22 8586 1 2.72 2.7562 13.662 ## Starting information for simulation # 23 ## Starting information for simulation # 24 ## Starting information for simulation # 25 98 25 3198 1 2.87 2.1516 13.658 98 25 3405 1 2.99 2.9040 13.271 98 25 3406 1 2.77 2.3997 13.140 98 25 3413 1 2.64 2.9367 12.954 98 25 3420 1 2.95 1.9772 12.640 98 25 9348 1 2.71 2.8196 13.557 98 25 9349 1 2.65 2.8891 13.409 98 25 9352 1 2.96 2.8674 14.060 ## Starting information for simulation # 26 ## Starting information for simulation # 27 98 27 5915 1 2.97 1.8008 13.565 98 27 5921 1 2.84 1.8146 13.664 ## Starting information for simulation # 28 98 28 982 1 2.91 2.7286 13.906 98 28 1016 1 2.98 1.9802 13.840 98 28 1019 1 2.81 2.4245 13.788 98 28 1022 1 2.76 2.6285 13.888 98 28 1023 1 2.69 2.1160 13.850 98 28 4618 1 2.88 2.6817 13.709 98 28 4886 1 2.73 2.2793 13.968 98 28 4897 1 2.82 2.4715 13.531 98 28 4916 1 2.72 2.3386 13.921 ## Starting information for simulation # 29 ## Starting information for simulation # 30 ## Starting information for simulation # 31 98 31 270 1 2.88 2.1416 13.574 98 31 7434 1 2.86 2.6090 13.157 98 31 7435 1 2.86 2.5178 13.294 98 31 7436 1 2.91 2.6770 12.844 98 31 7437 1 2.97 2.5184 12.772 98 31 7438 1 2.66 2.6286 13.336 98 31 7439 1 2.83 2.9590 12.981 98 31 7442 1 2.77 2.4316 12.974 98 31 7443 1 2.70 2.7484 13.119 ## Starting information for simulation # 32