0 mol 19 unq 0 iso 0 dist 9.85134 6.38574 6.59113 7.27506 14.0896 8.96634 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 5.82366 6.38574 5.31883 7.27506 9.75246 8.96634 numMergedOcc 0
2 mol 45 unq 0 iso 0 dist 7.70625 8.50375 5.85737 5.20813 7.43769 5.31095 numMergedOcc 0
3 mol 45 unq 1 iso 0 dist 6.01423 8.50375 3.61653 5.20813 5.2315 5.31095 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 9.43355 7.92479 3.68327 10.9396 9.57333 6.10199 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 7.9327 7.92479 15.3578 10.9396 18.7193 6.10199 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 9.56752 6.18681 5.57394 3.96397 13.2392 9.33968 numMergedOcc 0
7 mol 111 unq 0 iso 0 dist 9.10794 7.75479 8.11413 4.98364 9.83147 7.24101 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 7.33541 5.45882 11.746 3.85992 5.9758 6.13175 numMergedOcc 0
9 mol 113 unq 1 iso 0 dist 7.33541 4.57487 9.9322 3.85992 5.9758 4.34107 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 6.13559 8.61909 3.67473 5.27716 5.32751 5.45716 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 4.25566 6.50336 3.80087 4.80602 7.90709 8.56285 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 7.31037 6.50336 3.80763 4.80602 9.03842 8.56285 numMergedOcc 0
13 mol 141 unq 2 iso 0 dist 8.75562 9.68074 8.79381 4.01524 6.12485 7.70581 numMergedOcc 0
14 mol 141 unq 3 iso 0 dist 8.00449 9.68074 5.16197 4.01524 6.0262 7.70581 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 5.59555 5.50067 5.39801 13.2286 15.369 9.97939 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 5.59555 5.50067 5.39801 13.2286 15.369 9.97939 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 5.59555 5.50067 5.39801 13.2286 15.369 9.97939 numMergedOcc 0
