0 mol 8 unq 0 iso 0 dist 9.00925 8.68949 16.2669 6.88402 15.3607 8.70858 10.8849 19.557 9.42634 4.32141 numMergedOcc 0
1 mol 42 unq 0 iso 0 dist 8.84148 5.52834 5.21506 6.79455 11.6888 6.51963 10.1829 14.4319 9.39402 4.74211 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 7.8986 8.52643 7.05519 11.5903 9.14856 7.7933 10.9916 14.1776 8.6701 9.90881 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 7.24183 5.41357 7.05519 6.10515 9.14856 7.7933 7.48046 14.1776 8.6701 9.90881 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 9.27331 7.45777 4.68175 7.17416 11.9113 8.49022 7.85784 10.1296 5.88827 8.62193 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 9.27331 7.45777 4.68175 7.17416 11.9113 8.49022 14.3054 11.0617 9.66175 16.7825 numMergedOcc 0
6 mol 87 unq 0 iso 0 dist 9.10245 9.90256 5.83874 7.62644 12.6881 9.53368 13.3292 14.4582 9.20673 8.53566 numMergedOcc 0
7 mol 87 unq 1 iso 0 dist 9.10245 9.90256 5.83874 10.8096 11.2241 6.54532 13.3292 14.4582 9.20673 3.63275 numMergedOcc 0
8 mol 90 unq 0 iso 0 dist 6.6146 9.06641 5.12529 4.46847 9.05357 8.95044 4.77556 5.28331 7.01987 6.46537 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 9.6874 6.54778 4.84565 5.84883 10.8293 6.06039 5.72803 8.2575 5.87382 6.52215 numMergedOcc 0
10 mol 114 unq 1 iso 0 dist 9.6874 6.54778 4.84565 10.9953 13.5042 9.36502 5.72803 8.2575 5.87382 8.68818 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 9.07294 5.79195 5.35551 7.50288 10.4324 8.03691 4.37065 11.2252 8.98028 11.6675 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 5.12189 9.2759 10.8516 8.01541 8.49888 8.03691 15.7191 18.338 8.98028 11.6675 numMergedOcc 0
13 mol 133 unq 2 iso 0 dist 7.50126 9.2759 5.35551 8.01541 10.4324 8.03691 15.7191 11.2252 8.98028 11.6675 numMergedOcc 0
14 mol 148 unq 0 iso 0 dist 9.71692 9.18753 11.8278 6.16168 11.144 9.21934 8.03052 14.9179 9.0735 4.43652 numMergedOcc 0
15 mol 150 unq 0 iso 0 dist 9.73708 9.15244 11.6537 6.14967 11.1402 9.13113 8.06512 14.9398 9.03593 4.48089 numMergedOcc 0
16 mol 165 unq 0 iso 0 dist 8.2197 7.21397 10.5947 9.55225 10.0594 8.45742 6.22764 4.63353 8.00005 5.68382 numMergedOcc 0
17 mol 183 unq 0 iso 0 dist 7.69421 8.97652 9.01399 13.7069 16.5717 8.55287 14.3669 17.4248 8.69656 4.56996 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 7.02662 6.72718 6.12748 9.77203 13.0019 7.46024 8.09407 12.9744 8.92335 4.30589 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 7.58998 6.23677 6.88745 4.10214 4.64336 7.49889 10.602 14.3695 7.80646 13.7802 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 7.58998 6.23677 6.88745 6.78713 12.5784 9.89345 10.602 14.3695 7.80646 12.4219 numMergedOcc 0
21 mol 230 unq 0 iso 0 dist 6.88683 9.24729 11.0843 10.2514 14.2362 7.08409 4.45276 10.1927 9.62914 11.3508 numMergedOcc 0
22 mol 230 unq 1 iso 0 dist 6.88683 9.24729 11.0843 10.2514 14.2362 7.08409 15.7177 17.788 9.73038 15.1066 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 6.00654 8.86185 8.20191 7.57139 10.4752 6.98781 6.16212 9.94177 9.58325 3.78476 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 9.77392 9.62494 18.9489 12.9391 21.2727 9.85022 5.79323 12.7077 9.90506 16.2268 numMergedOcc 0
25 mol 266 unq 1 iso 0 dist 9.77392 9.62494 18.9489 12.9391 21.2727 9.85022 7.52317 13.6284 8.61077 16.7453 numMergedOcc 0
26 mol 266 unq 2 iso 0 dist 9.77392 9.62494 18.9489 12.9391 21.2727 9.85022 9.52953 14.9038 9.11585 17.4207 numMergedOcc 0
27 mol 282 unq 0 iso 0 dist 8.61456 9.98886 4.68809 10.1569 9.79549 5.98155 12.5442 13.4825 9.60384 3.70701 numMergedOcc 0
28 mol 282 unq 1 iso 0 dist 8.41041 6.81887 4.68809 4.54514 9.79549 5.98155 7.00145 13.4825 9.60384 3.70701 numMergedOcc 0
