# Bonding information for index 347 -- 0MA_14@O6 0MA_12@H6O 0MA_12@O6 # Index Sim # Frame Type Length Angle N-N dist ## Starting information for simulation # 1 ## Starting information for simulation # 2 347 2 1132 1 2.71 2.9122 12.928 347 2 1133 1 2.67 3.0569 12.783 347 2 1135 1 2.81 2.6738 12.880 347 2 1139 1 2.85 2.6536 12.939 347 2 1141 1 2.67 2.9036 13.301 347 2 8413 1 2.93 2.4076 10.726 347 2 8510 1 2.81 2.6463 11.075 ## Starting information for simulation # 3 ## Starting information for simulation # 4 ## Starting information for simulation # 5 ## Starting information for simulation # 6 347 6 4780 1 2.79 2.8187 9.571 347 6 4781 1 2.95 2.1426 9.625 347 6 5415 1 2.97 2.6246 10.109 347 6 5728 1 2.62 2.6786 10.800 347 6 6204 1 2.87 2.8247 8.995 347 6 6205 1 2.83 2.7280 8.700 347 6 6253 1 2.80 2.5204 9.866 347 6 6257 1 2.98 2.3401 9.340 347 6 7620 1 2.96 2.8675 9.821 347 6 7765 1 2.81 2.9999 9.915 347 6 7766 1 2.75 3.0065 9.584 347 6 7767 1 2.80 3.0939 9.062 347 6 7768 1 2.69 3.0700 8.452 347 6 7769 1 2.59 3.0894 9.173 347 6 7770 1 2.64 2.7867 9.051 347 6 7802 1 2.99 2.8677 8.949 347 6 8130 1 2.77 2.9614 8.633 347 6 8134 1 2.71 2.8643 8.601 347 6 8135 1 2.69 2.5994 9.180 347 6 8136 1 2.75 2.9825 8.960 347 6 8137 1 2.58 3.0501 9.712 347 6 8138 1 2.97 2.9870 8.885 347 6 8148 1 2.99 2.6096 9.393 347 6 8149 1 2.76 2.9741 9.217 347 6 8151 1 2.78 2.7024 8.727 347 6 8152 1 2.85 2.6423 8.950 347 6 8153 1 2.86 2.6969 9.336 347 6 9241 1 2.78 2.9064 10.368 347 6 9847 1 2.82 2.4719 10.532 347 6 9850 1 2.78 2.5815 11.056 347 6 9905 1 2.87 2.9031 10.714 347 6 9911 1 2.65 3.0044 10.823 347 6 9912 1 2.77 2.9971 10.716 ## Starting information for simulation # 7 347 7 9710 1 2.69 2.4360 11.428 347 7 9712 1 2.60 2.6037 11.744 347 7 9713 1 2.79 3.0064 11.847 347 7 9714 1 2.90 2.5238 12.260 347 7 9715 1 2.69 2.8553 12.335 347 7 9716 1 2.73 2.5697 12.157 347 7 9717 1 2.72 3.0836 12.449 347 7 9718 1 2.95 2.8224 12.029 347 7 9746 1 2.70 2.8897 12.451 347 7 9747 1 2.74 2.7330 12.621 347 7 9749 1 2.77 2.3324 12.486 347 7 9792 1 2.69 2.9350 12.070 347 7 9793 1 2.80 2.7242 12.436 347 7 9794 1 2.68 3.0483 11.945 347 7 9824 1 2.74 2.8178 10.006 347 7 9825 1 2.82 2.7671 11.080 347 7 9826 1 2.94 2.5102 11.702 347 7 9827 1 2.85 2.7640 12.117 347 7 9829 1 2.77 2.9801 12.657 347 7 9830 1 2.66 2.7595 11.850 347 7 9832 1 2.95 2.4711 12.617 347 7 9833 1 2.77 3.0907 12.440 347 7 9834 1 2.82 2.8424 12.304 347 7 9835 1 2.64 2.7522 12.561 347 7 9837 1 2.89 2.8531 12.463 347 7 9838 1 2.81 2.7135 12.306 347 7 9840 1 2.72 2.9134 12.066 347 7 9841 1 2.83 2.6740 11.996 347 7 9843 1 2.67 2.4743 11.625 347 7 9844 1 2.76 2.9625 11.932 ## Starting information for simulation # 8 ## Starting information for simulation # 9 ## Starting information for simulation # 10 347 10 9437 1 2.68 2.8931 10.877 ## Starting information for simulation # 11 347 11 4176 1 2.76 2.4497 11.521 347 11 8006 1 2.91 2.5381 12.847 347 11 8047 1 2.91 3.0165 13.417 347 11 8068 1 2.75 2.5718 13.286 347 11 8069 1 2.75 3.0185 13.764 347 11 8070 1 2.96 2.5567 13.648 347 11 8071 1 2.79 2.1449 13.496 347 11 8072 1 2.94 2.6932 13.255 347 11 8073 1 2.83 2.6282 13.189 347 11 8074 1 2.74 2.6474 13.489 347 11 8075 1 2.85 2.7052 13.557 347 11 8078 1 2.81 2.8699 13.004 347 11 8083 1 2.76 2.9869 11.613 347 11 8086 1 2.74 2.6253 12.032 347 11 8088 1 2.85 2.8605 11.502 347 11 8089 1 2.90 2.5139 11.278 347 11 8090 1 2.93 2.9880 10.799 347 11 8091 1 2.67 2.4536 11.037 347 11 8092 1 2.74 2.9367 10.538 347 11 8097 1 2.84 2.6165 11.258 347 11 8098 1 2.77 3.0432 11.552 347 11 8132 1 2.80 2.5595 12.213 347 11 8137 1 2.81 2.4328 11.442 347 11 8138 1 2.99 2.7850 12.248 347 11 8140 1 2.80 2.7451 11.397 347 11 8142 1 2.69 2.7217 12.775 347 11 8153 1 3.00 2.2557 12.785 347 11 8154 1 2.93 2.3609 12.980 347 11 8156 1 2.72 2.7430 12.592 347 11 8161 1 2.88 2.7653 12.960 347 11 8162 1 2.84 2.7293 12.606 347 11 8163 1 2.87 2.1240 12.843 347 11 8164 1 2.97 2.5205 12.315 347 11 8170 1 2.89 2.5450 10.887 347 11 8171 1 2.64 2.8031 12.308 347 11 8172 1 2.88 2.5035 12.547 347 11 8173 1 2.62 2.6204 12.716 347 11 8175 1 2.78 2.7216 12.403 347 11 8176 1 2.76 2.8836 12.926 347 11 8177 1 2.83 2.5135 12.680 347 11 8178 1 2.83 2.7115 13.295 347 11 8179 1 2.85 2.6845 13.127 347 11 8180 1 2.85 2.8960 12.851 347 11 8181 1 2.62 2.7353 12.471 347 11 8182 1 2.86 2.7136 12.809 347 11 8227 1 2.65 2.6147 12.062 347 11 8228 1 2.67 2.7243 12.067 347 11 8229 1 2.86 2.8266 11.928 347 11 8230 1 2.67 2.9361 12.710 347 11 8231 1 2.65 2.9368 12.324 347 11 8233 1 2.71 2.6707 11.737 347 11 8234 1 2.73 2.6965 12.169 347 11 8236 1 2.69 2.8948 12.024 347 11 8237 1 2.78 2.6614 11.910 347 11 8239 1 2.66 2.9676 12.541 347 11 8240 1 2.75 2.6236 12.270 347 11 8244 1 2.93 2.7226 12.632 347 11 8245 1 2.91 2.8899 13.474 347 11 8282 1 2.84 2.4062 12.874 347 11 8284 1 2.98 2.9284 12.482 347 11 8292 1 2.94 2.6611 12.474 347 11 8294 1 2.75 2.5708 12.850 347 11 8295 1 2.95 2.5595 12.865 347 11 8298 1 2.70 3.0486 12.461 347 11 8300 1 2.56 2.6680 12.032 ## Starting information for simulation # 12 ## Starting information for simulation # 13 347 13 958 1 2.76 2.6979 12.218 347 13 959 1 2.93 2.5443 12.102 347 13 963 1 2.95 2.0984 11.215 ## Starting information for simulation # 14 ## Starting information for simulation # 15 ## Starting information for simulation # 16 ## Starting information for simulation # 17 347 17 113 1 2.91 2.8600 13.530 347 17 114 1 2.90 2.9676 12.961 347 17 115 1 2.62 2.5371 12.859 347 17 116 1 2.83 2.7328 13.000 347 17 117 1 2.88 2.7325 12.561 347 17 118 1 2.98 2.7508 12.959 347 17 120 1 2.94 2.9327 12.671 347 17 9815 1 2.99 2.4607 12.100 347 17 9817 1 2.77 2.9047 12.280 347 17 9818 1 2.83 2.9571 12.176 347 17 9819 1 2.82 2.5576 12.257 347 17 9820 1 2.83 2.7601 12.163 347 17 9889 1 2.64 2.9758 9.922 347 17 9890 1 2.69 2.7030 9.518 347 17 9891 1 2.68 2.6994 9.122 ## Starting information for simulation # 18 ## Starting information for simulation # 19 347 19 1929 1 2.87 2.9444 10.589 347 19 5868 1 2.85 2.5379 12.631 ## Starting information for simulation # 20 ## Starting information for simulation # 21 ## Starting information for simulation # 22 347 22 4348 1 2.74 2.9799 12.757 347 22 4349 1 2.77 2.9154 12.912 347 22 4478 1 2.71 2.6209 13.525 347 22 4938 1 2.99 1.9997 13.588 347 22 4941 1 2.95 2.6737 13.891 347 22 8182 1 2.97 2.0441 13.785 ## Starting information for simulation # 23 347 23 3153 1 2.83 1.9425 10.321 347 23 3154 1 2.65 2.7720 10.551 347 23 3155 1 2.74 2.9591 9.895 347 23 3156 1 2.87 3.0185 9.910 347 23 3157 1 2.95 2.6853 10.105 347 23 3158 1 2.88 2.6481 10.378 347 23 3159 1 2.76 2.9297 10.362 347 23 3160 1 2.79 2.7122 10.038 347 23 3161 1 2.85 2.9239 11.719 347 23 3162 1 2.65 2.7871 11.149 347 23 3163 1 2.58 2.8334 10.801 347 23 3164 1 2.98 2.8289 10.962 347 23 3165 1 2.81 2.7707 10.002 347 23 3166 1 2.64 2.8816 10.518 347 23 3189 1 2.78 2.7453 9.331 347 23 3190 1 2.91 2.5684 8.895 ## Starting information for simulation # 24 ## Starting information for simulation # 25 ## Starting information for simulation # 26 347 26 4725 1 2.80 2.7132 12.826 ## Starting information for simulation # 27 ## Starting information for simulation # 28 ## Starting information for simulation # 29 347 29 5917 1 2.89 2.9269 12.836 347 29 5918 1 2.73 2.2283 13.582 347 29 5919 1 2.70 2.6920 13.276 347 29 5920 1 2.91 2.5604 13.285 347 29 5921 1 2.85 2.9589 13.686 347 29 5922 1 2.75 2.7133 13.508 347 29 5923 1 2.79 2.8379 13.767 347 29 5924 1 2.86 2.6294 14.277 347 29 5925 1 2.78 2.6723 13.901 347 29 5926 1 2.82 2.7833 14.015 347 29 5931 1 2.85 2.5577 13.423 347 29 5937 1 2.79 2.8138 13.176 347 29 5942 1 2.75 2.8801 13.332 347 29 5943 1 2.71 2.3775 13.585 347 29 5944 1 2.63 2.9839 13.479 347 29 5945 1 2.66 2.6172 13.611 347 29 5946 1 2.93 2.9469 13.560 347 29 5947 1 2.94 2.9347 13.104 347 29 5948 1 2.87 2.4997 13.183 347 29 5961 1 2.75 2.7632 13.251 347 29 5962 1 2.72 2.3410 13.301 ## Starting information for simulation # 30 ## Starting information for simulation # 31 ## Starting information for simulation # 32 ## Starting information for simulation # 33 347 33 2967 1 2.89 2.8490 13.105 347 33 2968 1 2.95 2.4140 12.792 347 33 2969 1 2.82 2.5397 12.863 347 33 3851 1 2.60 2.8404 13.479 347 33 3866 1 2.74 2.4086 12.764 347 33 3867 1 2.57 2.8489 12.522 347 33 3868 1 2.76 3.0501 12.179 347 33 3869 1 2.87 2.8926 12.990 347 33 3870 1 2.94 2.7787 12.683 347 33 4130 1 2.87 3.0861 13.326 347 33 5418 1 2.89 2.4992 10.224 347 33 5419 1 2.62 2.9844 10.401 347 33 7105 1 2.80 2.5817 10.734 347 33 7106 1 2.73 3.0293 11.157 347 33 7455 1 2.82 2.3712 9.060 347 33 7458 1 2.67 3.0581 8.746 347 33 7594 1 2.63 2.4437 9.545 347 33 7691 1 2.92 2.9018 8.669 347 33 7692 1 2.86 2.8542 7.857 347 33 7693 1 2.73 2.8602 8.794 347 33 7694 1 2.71 2.6454 8.826 347 33 7695 1 2.94 2.5415 9.198 347 33 8332 1 2.80 2.8395 8.484 ## Starting information for simulation # 34 347 34 6125 1 2.99 3.0156 12.968 347 34 6126 1 2.77 2.6979 12.730 347 34 6127 1 2.72 2.9094 13.382 347 34 6128 1 2.63 2.8844 12.805 347 34 6129 1 2.84 3.0266 13.460 347 34 7754 1 2.89 2.6714 13.980 347 34 7797 1 2.73 2.6735 13.996 347 34 7799 1 2.88 2.6684 13.920 347 34 8156 1 2.94 3.0177 12.727 347 34 8158 1 2.85 1.9432 12.457 347 34 8159 1 2.66 2.8977 12.243 347 34 8941 1 2.74 2.8131 11.795 347 34 9911 1 2.74 2.6192 10.809 347 34 10039 1 2.86 2.7312 12.283 ## Starting information for simulation # 35 ## Starting information for simulation # 36