# Bonding information for index 820 -- PRO_3@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 # 3 820 3 2156 2 2.58 2.7228 12.864 820 3 2247 2 2.71 2.4770 11.788 820 3 2278 2 2.75 2.6421 11.934 820 3 2293 2 2.63 2.4354 10.963 820 3 3160 2 2.95 2.4181 11.755 820 3 3161 2 2.99 2.8236 12.221 ## 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 ## 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 ## Starting information for simulation # 15 ## Starting information for simulation # 16 ## Starting information for simulation # 17 ## Starting information for simulation # 18 ## Starting information for simulation # 19 ## Starting information for simulation # 20 ## Starting information for simulation # 21 ## Starting information for simulation # 22 ## Starting information for simulation # 23 ## Starting information for simulation # 24 820 24 830 2 2.84 2.9250 10.907 820 24 857 2 2.68 2.6919 11.876 820 24 858 2 2.70 2.5609 11.199 820 24 859 2 2.76 2.7953 10.908 820 24 860 2 2.60 3.0461 11.369 820 24 4557 2 2.93 2.6551 11.412 820 24 9339 2 2.95 2.9925 11.702 820 24 9341 2 2.79 2.2636 11.863 820 24 9345 2 2.93 2.6760 12.331 820 24 9346 2 2.78 2.7924 11.758 820 24 9347 2 2.68 2.5469 12.204 820 24 9348 2 2.64 2.9824 11.822 820 24 9349 2 2.69 3.0573 12.246 820 24 9350 2 2.95 3.0708 11.597 820 24 9351 2 2.66 2.7192 11.910 820 24 9352 2 2.80 2.8848 11.889 820 24 9354 2 2.97 2.7672 11.524 820 24 9364 2 2.82 2.3441 11.904 ## Starting information for simulation # 25 ## Starting information for simulation # 26 ## Starting information for simulation # 27 ## Starting information for simulation # 28 ## Starting information for simulation # 29 ## Starting information for simulation # 30 ## Starting information for simulation # 31 820 31 14 2 2.84 2.8291 10.663 820 31 29 2 2.81 2.5318 10.843 820 31 111 2 2.59 2.7568 10.377 820 31 115 2 2.89 2.7540 10.436 820 31 116 2 2.64 3.0327 10.387 820 31 117 2 2.70 2.8076 10.744 820 31 120 2 2.77 2.6380 10.998 820 31 121 2 2.76 2.8345 10.268 820 31 122 2 2.78 2.5550 10.667 820 31 123 2 2.85 2.5446 10.466 820 31 124 2 2.83 2.7110 10.711 820 31 125 2 2.83 2.6082 10.875 820 31 126 2 2.82 2.4274 10.746 820 31 127 2 2.98 2.3961 10.991 820 31 129 2 2.88 2.4438 10.726 820 31 197 2 2.83 2.4043 10.758 820 31 199 2 2.64 2.4422 10.804 820 31 208 2 2.99 2.7561 10.442 820 31 210 2 2.57 2.6799 10.400 820 31 211 2 2.53 2.8492 10.742 820 31 212 2 2.99 2.5161 10.413 820 31 213 2 2.70 2.6731 10.954 820 31 214 2 2.95 2.5235 10.405 820 31 310 2 2.80 2.7259 10.840 820 31 827 2 2.83 2.8537 11.072 820 31 828 2 2.93 2.7048 11.171 820 31 1147 2 2.71 2.9383 11.231 820 31 1148 2 2.78 2.8545 11.038 820 31 1416 2 2.81 2.9035 10.654 820 31 1655 2 2.74 2.6204 11.832 820 31 1656 2 2.78 2.7792 11.008 820 31 1657 2 2.84 2.8974 11.544 820 31 1661 2 2.91 2.5334 10.329 820 31 1662 2 2.90 2.5999 10.202 820 31 2806 2 2.50 2.5868 10.917 820 31 2892 2 2.75 2.3679 10.751 820 31 3529 2 2.96 2.7223 11.819 820 31 3530 2 2.84 2.5269 12.317 820 31 3531 2 2.74 2.5479 12.312 820 31 3584 2 2.91 2.5454 11.484 820 31 3924 2 2.80 2.7834 11.327 820 31 3925 2 2.80 2.6226 10.634 820 31 3926 2 2.80 2.7348 11.297 820 31 3927 2 2.80 2.9795 11.385 820 31 3928 2 2.94 3.0709 12.045 820 31 3929 2 2.84 2.7820 12.193 820 31 3932 2 2.88 2.5954 11.889 820 31 3934 2 2.75 2.7781 11.825 820 31 3935 2 2.92 2.5740 12.171 820 31 3937 2 2.74 3.0850 11.960 820 31 3941 2 2.90 2.9891 11.686 820 31 3942 2 2.58 2.5421 11.904 820 31 6408 2 2.99 2.1905 12.692 820 31 6515 2 2.91 2.7333 13.073 820 31 6516 2 2.92 2.5834 12.782 820 31 7122 2 2.75 2.7865 13.109 820 31 8220 2 2.65 2.8245 12.695 820 31 8244 2 2.85 2.5929 12.660 820 31 8246 2 2.95 2.6341 12.778 820 31 8807 2 2.87 2.0100 12.590 820 31 8809 2 2.85 2.9439 12.818 820 31 8810 2 2.95 2.6829 12.521 820 31 8812 2 2.78 2.7738 12.473 ## Starting information for simulation # 32 ## Starting information for simulation # 33 820 33 2754 2 2.79 2.8167 12.949 820 33 2755 2 2.88 2.4840 12.298 820 33 2756 2 2.70 2.6685 11.968 820 33 9214 2 2.96 2.7869 8.322 ## Starting information for simulation # 34 820 34 10721 2 2.90 2.8756 11.867 820 34 10722 2 2.69 2.9483 11.776 820 34 10723 2 2.71 2.7672 11.472 820 34 10725 2 2.99 2.5182 11.931 820 34 10726 2 2.69 2.7527 12.823 820 34 10730 2 2.79 2.4228 12.353 820 34 10731 2 2.64 2.9215 12.310 820 34 10732 2 2.72 2.6310 12.582 820 34 10733 2 2.74 2.9217 12.009 820 34 10734 2 2.68 2.5874 11.945 820 34 10741 2 2.72 2.9164 10.882 820 34 10750 2 2.68 2.6299 12.224 820 34 10751 2 2.69 2.9926 12.687 820 34 10752 2 2.74 2.9824 12.537 820 34 10753 2 2.87 2.6368 12.574 820 34 10754 2 2.83 3.0031 12.671 820 34 10755 2 2.79 2.9483 12.286 820 34 10758 2 2.76 2.9614 13.134 820 34 10784 2 2.60 2.8854 10.907 820 34 10785 2 2.79 2.6104 10.733 820 34 10786 2 2.58 2.7762 10.826 820 34 10795 2 2.82 2.6023 9.983 820 34 10796 2 2.63 2.6925 10.868 820 34 10797 2 2.67 2.8170 11.233 820 34 10798 2 2.76 2.6918 10.899 820 34 10799 2 2.90 2.8785 12.188 820 34 10800 2 2.73 2.9254 11.793 820 34 10801 2 2.67 2.9551 12.689 820 34 10802 2 2.79 2.5606 11.897 820 34 10803 2 2.78 2.4905 11.848 820 34 10807 2 2.69 2.9006 11.837 820 34 10808 2 2.68 2.5142 12.113 820 34 10820 2 2.98 2.9089 11.327 820 34 10822 2 2.87 2.9193 12.634 820 34 10829 2 2.87 2.8907 12.406 820 34 10833 2 2.75 2.3611 12.136 820 34 10843 2 2.97 2.3969 11.237 820 34 10847 2 2.61 3.0437 12.110 820 34 10848 2 2.92 2.9075 12.168 820 34 10849 2 2.76 2.0131 11.885 820 34 10850 2 2.69 2.8317 12.595 820 34 10851 2 2.68 2.3531 12.334 820 34 10857 2 2.79 2.5490 12.543 820 34 10865 2 2.67 2.9705 12.119 820 34 10871 2 2.78 2.5954 12.554 820 34 10878 2 2.89 2.0016 12.639 820 34 10881 2 2.83 3.0451 13.251 820 34 10882 2 2.90 1.9413 13.099 820 34 10883 2 2.90 2.6276 13.416 ## Starting information for simulation # 35 820 35 7713 2 2.80 2.6508 12.818 820 35 7714 2 2.88 2.6324 13.162 820 35 7715 2 2.75 2.6940 12.960 820 35 7742 2 2.90 2.6629 12.815 820 35 7744 2 2.69 2.6019 12.615 820 35 7837 2 2.96 2.5257 11.755 820 35 9533 2 2.77 2.7912 12.133 ## Starting information for simulation # 36