0 mol 5 unq 0 iso 0 dist 7.0627 8.35174 5.69239 10.988 4.05341 6.66949 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 9.06004 6.82054 4.78873 5.65377 3.82411 4.41045 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 5.92771 4.38299 3.77542 6.47185 3.8412 5.81662 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 6.42645 7.49995 4.46067 9.09269 3.70802 7.49792 numMergedOcc 0
4 mol 62 unq 1 iso 0 dist 6.42645 7.49995 4.46067 9.00731 3.66673 6.58981 numMergedOcc 0
5 mol 176 unq 0 iso 0 dist 6.95058 5.37694 8.65645 9.56967 3.75017 9.40603 numMergedOcc 0
6 mol 176 unq 1 iso 0 dist 6.95058 4.99447 6.85902 7.66242 3.84631 8.00223 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 7.00278 6.46602 8.32259 7.79856 6.82158 7.15344 numMergedOcc 0
8 mol 204 unq 1 iso 0 dist 7.00278 8.23616 9.93489 7.79856 6.82158 9.98617 numMergedOcc 0
9 mol 204 unq 2 iso 0 dist 8.50234 8.70089 8.54737 15.5331 11.8793 7.15344 numMergedOcc 0
10 mol 204 unq 3 iso 0 dist 8.50234 5.77393 7.64057 15.5331 11.8793 9.98617 numMergedOcc 0
11 mol 260 unq 0 iso 0 dist 8.56451 5.45648 7.04263 11.1424 9.99682 9.11501 numMergedOcc 0
12 mol 266 unq 0 iso 0 dist 9.02396 15.2885 8.25286 19.5239 11.313 5.28746 numMergedOcc 0
13 mol 266 unq 1 iso 0 dist 7.48115 15.2885 9.9965 19.5239 13.005 5.28746 numMergedOcc 0
14 mol 283 unq 0 iso 0 dist 8.3831 5.93642 7.31132 12.282 4.3196 9.82274 numMergedOcc 0
15 mol 283 unq 1 iso 0 dist 8.3831 5.93642 7.31132 9.72248 6.30031 7.17276 numMergedOcc 0
16 mol 284 unq 0 iso 0 dist 4.69611 3.39008 5.6964 7.41633 5.88619 5.2862 numMergedOcc 0
17 mol 284 unq 1 iso 0 dist 4.69611 3.39008 5.6964 5.52837 4.57529 5.31097 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 8.08382 6.1158 4.68668 6.81636 11.4589 8.4625 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 8.08382 6.1158 4.68668 6.81636 11.4589 8.4625 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 8.08382 6.1158 4.68668 6.81636 11.4589 8.4625 numMergedOcc 0
