0 mol 7 unq 0 iso 0 dist 4.47024 4.91115 8.60435 5.83658 6.58469 6.02702 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 4.47024 4.91115 8.60435 13.5317 16.4405 8.72114 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.29595 14.2823 6.59455 13.9275 9.87669 7.32257 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 8.29595 14.2823 6.59455 17.1403 11.4245 6.55811 numMergedOcc 0
4 mol 9 unq 2 iso 0 dist 8.29595 14.2823 6.59455 21.5143 14.7278 8.64915 numMergedOcc 0
5 mol 9 unq 3 iso 0 dist 8.29595 11.69 5.71201 17.1403 11.4245 8.48677 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 9.23617 12.9223 6.39966 14.2971 5.18512 6.41575 numMergedOcc 0
7 mol 19 unq 1 iso 0 dist 9.23617 12.9223 6.39966 18.119 9.47529 6.41423 numMergedOcc 0
8 mol 19 unq 2 iso 0 dist 8.59114 10.8426 6.39966 12.8189 5.18512 6.41575 numMergedOcc 0
9 mol 19 unq 3 iso 0 dist 8.59114 10.8426 6.39966 14.4543 9.47529 6.41423 numMergedOcc 0
10 mol 19 unq 4 iso 0 dist 8.63204 10.5195 6.39966 8.18518 5.18512 6.41575 numMergedOcc 0
11 mol 19 unq 5 iso 0 dist 8.63204 10.5195 6.39966 12.9091 9.47529 6.41423 numMergedOcc 0
12 mol 24 unq 0 iso 0 dist 4.61828 10.7574 9.69752 6.85331 6.00575 7.33768 numMergedOcc 0
13 mol 24 unq 1 iso 0 dist 4.61828 12.8157 9.36461 21.1799 17.4067 8.4051 numMergedOcc 0
14 mol 24 unq 2 iso 0 dist 4.61828 12.8157 9.36461 6.85331 6.00575 7.29868 numMergedOcc 0
15 mol 24 unq 3 iso 0 dist 4.61828 12.8157 9.36461 10.4452 5.97304 8.60554 numMergedOcc 0
16 mol 75 unq 0 iso 0 dist 6.59253 6.05353 7.6433 7.16583 5.36954 9.81166 numMergedOcc 0
17 mol 105 unq 0 iso 0 dist 5.74652 7.94584 7.71923 10.4998 5.15287 9.06288 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 8.84146 15.2909 8.8562 13.052 4.99056 9.11344 numMergedOcc 0
19 mol 119 unq 1 iso 0 dist 8.84146 15.2909 8.8562 10.2589 3.78311 6.52773 numMergedOcc 0
20 mol 119 unq 2 iso 0 dist 8.84146 4.96177 7.91683 10.2589 3.78311 9.23858 numMergedOcc 0
21 mol 126 unq 0 iso 0 dist 7.68174 8.31794 5.94233 12.477 5.5703 6.30546 numMergedOcc 0
22 mol 126 unq 1 iso 0 dist 7.68174 9.33341 8.56219 11.5944 9.71711 6.29233 numMergedOcc 0
23 mol 135 unq 0 iso 0 dist 5.97971 11.1112 9.40325 10.2198 5.66293 5.62052 numMergedOcc 0
24 mol 135 unq 1 iso 0 dist 5.97971 11.1112 9.40325 13.3672 10.1275 7.85645 numMergedOcc 0
25 mol 135 unq 2 iso 0 dist 5.97971 6.32401 7.62606 10.2198 5.66293 7.90563 numMergedOcc 0
26 mol 135 unq 3 iso 0 dist 5.97971 6.32401 7.62606 13.3672 10.1275 8.97655 numMergedOcc 0
27 mol 163 unq 0 iso 0 dist 6.96572 9.55101 7.8639 10.8231 3.89889 9.69121 numMergedOcc 0
28 mol 171 unq 0 iso 0 dist 6.81707 6.4423 8.1536 6.01711 5.487 9.61462 numMergedOcc 0
29 mol 222 unq 0 iso 0 dist 9.04499 13.0565 9.08955 7.27481 6.42798 9.07471 numMergedOcc 0
30 mol 243 unq 0 iso 0 dist 8.54245 9.97818 7.44706 17.0898 11.3773 7.49645 numMergedOcc 0
31 mol 243 unq 1 iso 0 dist 8.54245 9.97818 7.44706 18.8081 13.3907 9.9222 numMergedOcc 0
32 mol 284 unq 0 iso 0 dist 5.68818 7.98227 9.63007 13.262 11.8906 9.33437 numMergedOcc 0
33 mol 284 unq 1 iso 0 dist 5.68818 7.98227 9.63007 8.08993 6.4399 7.8343 numMergedOcc 0
