# Bonding information for index 332 -- 0MA_14@O5 0MA_15@H3O 0MA_15@O3 # Index Sim # Frame Type Length Angle N-N dist ## Starting information for simulation # 1 ## Starting information for simulation # 2 332 2 462 1 2.83 2.1767 9.618 332 2 463 1 2.75 2.9710 10.372 332 2 471 1 2.80 2.6293 9.771 332 2 472 1 2.93 2.0497 9.767 332 2 474 1 2.66 2.8811 10.286 332 2 479 1 2.84 2.7539 10.620 332 2 480 1 2.90 2.5889 9.975 332 2 6310 1 2.68 2.6788 9.266 332 2 6313 1 2.68 2.8352 8.084 332 2 6314 1 2.73 2.7394 8.832 332 2 6315 1 2.94 1.8611 8.688 332 2 6351 1 2.80 3.0231 9.097 332 2 8332 1 2.96 2.8483 12.234 332 2 8338 1 2.86 2.6515 11.087 332 2 8353 1 2.73 1.9552 11.384 332 2 8358 1 2.84 2.0983 10.670 332 2 8361 1 2.75 2.8656 10.637 ## Starting information for simulation # 3 332 3 943 1 2.73 2.7943 9.311 332 3 1387 1 2.89 2.6485 10.353 332 3 1395 1 2.75 3.0296 10.557 332 3 1403 1 2.68 2.7188 11.308 332 3 4318 1 2.94 1.8070 12.096 332 3 4325 1 2.73 1.8240 11.924 ## Starting information for simulation # 4 ## Starting information for simulation # 5 ## Starting information for simulation # 6 332 6 2841 1 2.91 2.4526 9.766 332 6 2843 1 2.89 1.9031 10.495 332 6 2846 1 2.96 2.6300 10.024 ## Starting information for simulation # 7 332 7 7913 1 2.84 2.5523 11.496 332 7 8319 1 2.92 2.4874 11.811 332 7 8324 1 2.86 2.7304 12.036 332 7 8600 1 2.69 2.5151 10.490 332 7 8601 1 2.75 2.7616 10.163 332 7 8613 1 2.71 2.9049 11.320 332 7 8614 1 2.80 2.6925 10.025 332 7 8617 1 2.95 3.1190 9.680 332 7 8618 1 2.77 2.3598 9.964 332 7 8622 1 2.97 2.0812 10.450 332 7 8625 1 2.76 2.7226 9.881 332 7 8626 1 2.80 2.4069 9.939 332 7 8627 1 2.97 2.0992 10.301 332 7 8736 1 2.62 2.6930 11.682 332 7 8737 1 2.72 2.5968 12.195 332 7 8739 1 2.89 2.6639 11.784 332 7 8740 1 2.71 2.5925 10.958 332 7 8741 1 2.77 2.9232 11.842 332 7 9033 1 2.77 2.9008 12.170 332 7 9465 1 2.93 2.9755 12.551 ## Starting information for simulation # 8 ## Starting information for simulation # 9 ## Starting information for simulation # 10 332 10 8069 1 2.73 2.6073 7.933 332 10 8108 1 2.80 2.3607 9.402 332 10 8110 1 2.74 2.9227 9.133 332 10 8159 1 2.75 2.8636 8.857 332 10 8166 1 2.89 2.9870 8.634 332 10 8168 1 2.91 2.2783 8.397 332 10 8172 1 2.96 2.2526 8.262 332 10 8199 1 2.76 2.8625 7.329 332 10 8221 1 2.81 2.5993 7.051 332 10 8227 1 2.82 2.2893 7.160 ## Starting information for simulation # 11 ## Starting information for simulation # 12 ## Starting information for simulation # 13 ## Starting information for simulation # 14 ## Starting information for simulation # 15 332 15 8881 1 2.76 2.9903 12.187 332 15 8886 1 2.94 2.1256 10.444 332 15 8909 1 2.97 2.1514 12.312 332 15 8939 1 2.66 2.8573 11.478 332 15 8940 1 2.94 2.3720 11.130 332 15 8941 1 2.97 2.8113 11.398 332 15 9393 1 2.75 2.5278 11.513 ## Starting information for simulation # 16 ## Starting information for simulation # 17 332 17 6068 1 2.93 1.8350 11.663 ## Starting information for simulation # 18 ## Starting information for simulation # 19 ## Starting information for simulation # 20 332 20 9569 1 2.88 2.9062 6.420 332 20 9595 1 2.65 2.9811 6.426 332 20 9596 1 2.77 2.9262 6.715 332 20 9598 1 2.89 2.7890 6.574 332 20 9599 1 2.81 2.9936 6.487 332 20 9609 1 2.84 2.6810 6.131 332 20 9611 1 2.91 2.6278 6.237 332 20 9620 1 2.70 2.9639 5.916 332 20 9633 1 2.76 2.6303 6.360 332 20 9648 1 2.66 2.8619 5.875 332 20 9665 1 2.87 2.9339 6.096 332 20 9670 1 2.82 2.7271 6.662 332 20 9708 1 2.99 2.9725 6.471 332 20 9726 1 3.00 2.7626 6.003 332 20 9732 1 2.82 2.6957 6.299 332 20 9733 1 2.84 2.8063 6.074 332 20 9745 1 2.68 2.6570 6.031 332 20 9759 1 2.82 2.6578 8.198 332 20 9792 1 2.83 3.0170 7.308 332 20 9793 1 2.58 2.4409 7.142 332 20 9794 1 2.88 2.6492 7.088 ## Starting information for simulation # 21 332 21 3792 1 3.00 1.8255 7.189 332 21 3867 1 2.91 2.9631 6.118 332 21 4002 1 2.76 3.0106 6.199 332 21 4125 1 2.89 2.8885 7.184 332 21 4757 1 2.73 2.9667 6.500 332 21 4758 1 2.97 2.8488 6.765 332 21 4759 1 2.90 2.8527 6.625 332 21 4760 1 2.71 2.6924 7.098 332 21 4766 1 2.93 2.9597 7.321 332 21 4767 1 2.71 3.0055 6.940 332 21 4805 1 2.70 2.6651 5.908 332 21 4806 1 2.85 2.3207 6.272 332 21 4807 1 2.75 2.8838 6.289 332 21 4851 1 2.77 2.9923 7.639 332 21 4852 1 2.83 2.3810 6.448 332 21 4853 1 2.89 2.4342 6.925 332 21 4856 1 2.99 3.0219 6.389 332 21 4889 1 2.94 2.9919 6.403 332 21 4898 1 2.85 2.5961 5.894 332 21 4904 1 2.88 2.6251 6.229 332 21 4905 1 2.95 2.3492 6.373 332 21 5123 1 2.99 2.7802 6.759 332 21 5154 1 2.97 2.6656 6.934 332 21 5160 1 2.81 2.9014 6.777 332 21 5168 1 2.69 3.0766 6.281 332 21 5169 1 2.93 2.9351 5.875 332 21 5210 1 2.63 3.0204 6.810 332 21 5251 1 2.68 2.8183 7.070 332 21 5431 1 2.75 2.5391 5.743 332 21 5432 1 2.94 2.2823 5.636 332 21 5436 1 2.94 1.7797 6.072 332 21 5455 1 2.69 2.9250 5.846 332 21 5479 1 2.69 2.9064 5.139 332 21 5488 1 2.84 3.1048 4.721 332 21 5489 1 2.66 2.8531 4.250 332 21 5491 1 2.85 2.8728 4.945 332 21 5493 1 2.66 2.5518 4.705 332 21 5494 1 2.65 2.6100 5.128 332 21 5495 1 2.83 2.5664 4.851 332 21 5531 1 2.81 2.6201 4.817 332 21 5532 1 2.80 2.7006 4.986 332 21 5537 1 2.87 2.5757 5.466 332 21 5538 1 2.59 2.9304 4.758 332 21 5547 1 2.67 2.7044 5.394 332 21 5548 1 2.99 2.8545 5.653 332 21 5551 1 2.95 2.5715 5.771 332 21 5552 1 2.79 2.6107 5.986 ## Starting information for simulation # 22 ## Starting information for simulation # 23 332 23 4867 1 2.82 2.7530 10.743 332 23 4870 1 2.98 2.4784 10.752 332 23 4871 1 2.88 2.2349 11.188 332 23 7489 1 2.83 2.9566 10.879 332 23 7558 1 2.83 3.0322 10.842 332 23 8079 1 2.88 2.6214 10.833 332 23 8080 1 2.90 2.8948 10.742 332 23 8082 1 2.89 2.7440 10.729 332 23 8083 1 3.00 2.2307 11.211 ## Starting information for simulation # 24 332 24 4878 1 2.78 2.8079 11.960 332 24 5440 1 2.74 2.1922 11.345 332 24 5449 1 2.80 2.9756 11.072 332 24 7704 1 2.75 2.8021 12.371 332 24 8623 1 2.87 2.2974 12.646 332 24 9102 1 2.66 2.8077 11.873 ## Starting information for simulation # 25 332 25 6428 1 2.86 2.9185 11.461 332 25 6429 1 2.72 2.9753 10.933 ## Starting information for simulation # 26 ## Starting information for simulation # 27 332 27 7983 1 2.81 2.6614 10.912 332 27 7984 1 2.68 3.0181 10.943 332 27 8197 1 2.99 2.1834 11.720 ## 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 # 33 332 33 3470 1 2.91 2.7719 12.718 332 33 3472 1 2.79 3.0855 12.159 332 33 4858 1 2.74 2.7652 12.831 332 33 4861 1 2.89 2.6208 12.126 332 33 4862 1 2.87 2.9204 12.780 ## Starting information for simulation # 34 ## Starting information for simulation # 35 ## Starting information for simulation # 36