0 mol 9 unq 0 iso 0 dist 9.36946 10.172 7.9944 5.4068 7.032 5.06358 12.5274 4.58685 6.55811 8.64915 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 9.36946 10.172 7.9944 5.4068 7.032 5.06358 12.4763 5.83039 7.36018 8.17347 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 9.36946 10.172 7.9944 5.4068 7.032 5.06358 16.203 9.06304 8.48677 11.3467 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 9.36946 5.4068 7.032 10.172 7.9944 5.06358 12.5274 4.58685 8.64915 6.55811 numMergedOcc 0
4 mol 9 unq 4 iso 0 dist 9.36946 5.4068 7.032 10.172 7.9944 5.06358 12.4763 5.83039 8.17347 7.36018 numMergedOcc 0
5 mol 9 unq 5 iso 0 dist 9.36946 5.4068 7.032 10.172 7.9944 5.06358 10.445 9.193 7.83133 10.2602 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 8.41365 13.4414 6.92532 6.92576 7.48847 10.8007 20.0127 13.9675 7.75618 15.4288 numMergedOcc 0
7 mol 19 unq 1 iso 0 dist 8.41365 13.4414 6.92532 10.5285 6.36455 5.03957 20.0127 13.9675 7.75618 12.3215 numMergedOcc 0
8 mol 24 unq 0 iso 0 dist 5.78238 9.59761 6.60423 5.641 7.83786 7.05502 16.7308 11.9395 9.41441 16.0926 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 6.59232 5.72472 5.16364 6.71593 8.85586 8.07446 11.7493 9.03289 6.02816 12.4089 numMergedOcc 0
10 mol 148 unq 0 iso 0 dist 5.29515 10.7866 9.74542 7.12546 9.02318 6.83844 12.0052 7.23332 9.91993 13.4961 numMergedOcc 0
11 mol 148 unq 1 iso 0 dist 5.29515 10.7866 9.74542 7.12546 9.02318 6.83844 11.7851 7.89336 6.22055 10.8708 numMergedOcc 0
12 mol 148 unq 2 iso 0 dist 5.29515 10.7866 9.74542 5.2593 7.97543 8.72919 12.0052 7.23332 9.91993 12.1227 numMergedOcc 0
13 mol 148 unq 3 iso 0 dist 5.29515 10.7866 9.74542 5.2593 7.97543 8.72919 11.7851 7.89336 6.22055 11.2961 numMergedOcc 0
14 mol 150 unq 0 iso 0 dist 5.16917 10.734 9.6606 5.1918 7.85526 8.77324 12.0168 7.35366 9.96691 12.1516 numMergedOcc 0
15 mol 150 unq 1 iso 0 dist 5.16917 10.734 9.6606 5.1918 7.85526 8.77324 11.6886 7.86976 6.14675 11.2313 numMergedOcc 0
16 mol 150 unq 2 iso 0 dist 5.16917 10.734 9.6606 5.1918 7.85526 8.77324 15.9383 11.8012 9.24244 15.2191 numMergedOcc 0
17 mol 150 unq 3 iso 0 dist 5.16917 10.734 9.6606 7.02896 8.94552 6.98865 12.0168 7.35366 9.96691 13.6809 numMergedOcc 0
18 mol 150 unq 4 iso 0 dist 5.16917 10.734 9.6606 7.02896 8.94552 6.98865 11.6886 7.86976 6.14675 10.9703 numMergedOcc 0
19 mol 150 unq 5 iso 0 dist 5.16917 10.734 9.6606 7.02896 8.94552 6.98865 15.9383 11.8012 9.24244 14.9682 numMergedOcc 0
20 mol 171 unq 0 iso 0 dist 7.11599 12.3586 7.71426 9.45239 5.10618 7.31409 12.9816 6.29877 5.93786 8.24693 numMergedOcc 0
21 mol 171 unq 1 iso 0 dist 7.11599 12.3586 7.71426 9.45239 5.10618 7.31409 12.9808 5.90358 8.1344 6.71356 numMergedOcc 0
22 mol 171 unq 2 iso 0 dist 7.11599 12.3586 7.71426 6.08244 9.86681 13.6814 12.9816 6.29877 5.93786 13.8551 numMergedOcc 0
23 mol 171 unq 3 iso 0 dist 7.11599 12.3586 7.71426 6.08244 9.86681 13.6814 12.9808 5.90358 8.1344 15.2816 numMergedOcc 0
24 mol 171 unq 4 iso 0 dist 7.11599 9.45239 5.10618 12.3586 7.71426 7.31409 12.9816 6.29877 8.24693 5.93786 numMergedOcc 0
25 mol 171 unq 5 iso 0 dist 7.11599 9.45239 5.10618 12.3586 7.71426 7.31409 12.9808 5.90358 6.71356 8.1344 numMergedOcc 0
26 mol 171 unq 6 iso 0 dist 7.11599 9.45239 5.10618 6.08244 9.86681 13.7214 12.9816 6.29877 8.24693 13.8551 numMergedOcc 0
27 mol 171 unq 7 iso 0 dist 7.11599 9.45239 5.10618 6.08244 9.86681 13.7214 12.9808 5.90358 6.71356 15.2816 numMergedOcc 0
28 mol 186 unq 0 iso 0 dist 9.51006 10.568 7.20574 11.1286 6.85302 5.74635 13.6647 11.8992 8.73217 14.2425 numMergedOcc 0
29 mol 194 unq 0 iso 0 dist 9.13708 5.03763 6.26839 12.8318 8.12346 8.0179 10.6315 5.92931 8.65535 12.0009 numMergedOcc 0
30 mol 194 unq 1 iso 0 dist 9.13708 5.03763 6.26839 16.5287 8.83356 14.6506 10.6315 5.92931 8.65535 12.645 numMergedOcc 0
31 mol 194 unq 2 iso 0 dist 9.13708 5.03763 6.26839 11.4735 8.2654 8.48054 10.6315 5.92931 8.65535 13.9101 numMergedOcc 0
32 mol 194 unq 3 iso 0 dist 9.13708 16.5287 8.83356 5.03763 6.26839 14.6506 15.691 12.361 8.29382 16.3687 numMergedOcc 0
33 mol 194 unq 4 iso 0 dist 9.13708 16.5287 8.83356 5.03763 6.26839 14.6506 12.6412 7.50057 6.72379 12.4952 numMergedOcc 0
34 mol 194 unq 5 iso 0 dist 9.13708 16.5287 8.83356 12.8318 8.12346 13.5632 15.691 12.361 8.29382 18.4977 numMergedOcc 0
35 mol 194 unq 6 iso 0 dist 9.13708 16.5287 8.83356 12.8318 8.12346 13.5632 12.6412 7.50057 6.72379 15.1649 numMergedOcc 0
36 mol 194 unq 7 iso 0 dist 9.13708 16.5287 8.83356 11.4735 8.2654 11.6097 15.691 12.361 8.29382 14.3769 numMergedOcc 0
37 mol 194 unq 8 iso 0 dist 9.13708 16.5287 8.83356 11.4735 8.2654 11.6097 12.6412 7.50057 6.72379 13.2138 numMergedOcc 0
38 mol 234 unq 0 iso 0 dist 4.7359 4.74041 8.24186 4.67725 7.56091 8.59858 10.2618 9.68666 9.81425 13.5134 numMergedOcc 0
39 mol 234 unq 1 iso 0 dist 4.7359 4.74041 8.24186 6.16697 7.5366 5.88703 10.2618 9.68666 9.81425 13.293 numMergedOcc 0
40 mol 235 unq 0 iso 0 dist 7.22411 10.6339 6.39158 6.25956 7.75722 12.1984 13.6439 7.85398 6.36341 12.0305 numMergedOcc 0
41 mol 279 unq 0 iso 0 dist 7.92537 9.73122 6.43341 13.9298 8.29305 6.67478 6.12347 5.89415 9.09855 13.6219 numMergedOcc 0
