0 mol 0 unq 0 iso 0 dist 8.24206 5.25456 7.37981 9.56842 7.30381 5.24778 6.19218 9.98828 7.19621 11.9766 numMergedOcc 0
1 mol 2 unq 0 iso 0 dist 9.08872 9.97525 9.58976 5.30739 9.9859 12.4493 9.74371 6.23988 6.35342 9.57674 numMergedOcc 0
2 mol 2 unq 1 iso 0 dist 9.74371 9.97525 6.35342 5.30739 9.57674 12.4493 9.08872 6.23988 9.58976 9.9859 numMergedOcc 0
3 mol 2 unq 2 iso 0 dist 7.37296 11.2776 9.58976 15.0954 9.9859 12.4493 11.9277 6.23988 6.35342 9.57674 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 8.30431 6.32949 9.62468 10.8154 9.32664 15.5028 4.628 8.0979 5.92705 10.5121 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.60363 10.8067 9.72442 15.52 9.53327 10.1488 9.27355 4.4628 9.68526 12.4862 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.60363 16.3515 9.02288 15.52 9.53327 14.6243 12.4571 7.64038 9.58544 11.5958 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 9.27331 10.163 9.72442 6.41591 9.53327 10.1488 10.0291 4.4628 9.68526 12.4862 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 9.27331 12.3394 9.02288 6.41591 9.53327 14.6243 13.8777 7.64038 9.58544 11.5958 numMergedOcc 0
9 mol 100 unq 0 iso 0 dist 7.11187 6.67262 6.78459 12.8792 9.95103 7.16919 11.7021 10.2399 7.88564 12.0785 numMergedOcc 0
10 mol 100 unq 1 iso 0 dist 6.60356 9.96864 6.78459 10.0156 9.95103 7.16919 16.023 10.2399 7.88564 12.0785 numMergedOcc 0
11 mol 108 unq 0 iso 0 dist 9.32474 5.60268 7.29462 9.54469 6.80069 10.1805 8.80334 6.45014 5.4057 12.2332 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 6.21546 5.73338 8.69888 10.3139 9.27911 15.6247 6.03184 7.01839 5.08206 13.2069 numMergedOcc 0
13 mol 175 unq 1 iso 0 dist 6.21546 5.73338 8.69888 7.04147 8.57607 12.7456 6.03184 7.01839 5.08206 11.4305 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 8.78709 9.49952 6.00053 4.38798 5.67112 7.16549 15.5964 8.67658 7.44191 13.2143 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 8.63033 12.1408 9.72979 4.77368 6.69623 11.7977 17.6979 13.4033 8.31638 15.1666 numMergedOcc 0
16 mol 206 unq 1 iso 0 dist 8.63033 9.19627 6.97859 4.77368 6.69623 10.4747 14.4518 6.09091 9.38127 12.2414 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 7.47122 15.4433 9.75313 5.93235 6.48885 10.7174 18.5793 11.6002 6.08709 15.2008 numMergedOcc 0
18 mol 224 unq 1 iso 0 dist 6.6537 4.55824 9.75313 6.66792 6.48885 10.7174 9.08719 11.6002 6.08709 15.2008 numMergedOcc 0
19 mol 224 unq 2 iso 0 dist 7.58998 6.87755 6.23882 5.54596 8.81349 9.2363 11.9987 6.35724 6.56437 12.3339 numMergedOcc 0
20 mol 224 unq 3 iso 0 dist 7.58998 6.87755 6.23882 5.54596 8.81349 9.2363 15.2131 13.2305 9.53131 18.722 numMergedOcc 0
21 mol 224 unq 4 iso 0 dist 7.58998 6.87755 6.23882 5.54596 8.81349 9.2363 12.0605 14.027 9.34636 16.6845 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 9.07452 6.11218 7.80446 16.1753 8.30714 13.0115 7.21004 10.3541 9.91395 14.6318 numMergedOcc 0
23 mol 274 unq 1 iso 0 dist 9.07452 11.3921 9.86142 16.1753 8.30714 11.5044 18.1637 12.757 7.79904 9.61642 numMergedOcc 0
24 mol 274 unq 2 iso 0 dist 6.44266 6.98398 7.80446 7.28382 8.30714 13.0115 8.75703 10.3541 9.91395 14.6318 numMergedOcc 0
25 mol 274 unq 3 iso 0 dist 6.44266 6.99898 9.86142 7.28382 8.30714 11.5044 10.6014 12.757 7.79904 9.61642 numMergedOcc 0
