0 mol 7 unq 0 iso 0 dist 4.47024 6.08819 9.54727 4.91115 8.60435 6.11915 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 8.29595 16.6981 8.69493 16.5531 8.55446 5.54438 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 8.29595 16.6981 8.69493 14.2823 6.59455 6.57322 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 8.29595 16.6981 8.69493 11.69 5.71201 7.5263 numMergedOcc 0
4 mol 9 unq 3 iso 0 dist 8.29595 13.0211 7.02963 16.5531 8.55446 9.91187 numMergedOcc 0
5 mol 9 unq 4 iso 0 dist 8.29595 13.0211 7.02963 14.2823 6.59455 9.06833 numMergedOcc 0
6 mol 9 unq 5 iso 0 dist 8.29595 13.0211 7.02963 11.69 5.71201 5.38864 numMergedOcc 0
7 mol 19 unq 0 iso 0 dist 9.23617 5.83115 8.41365 12.9223 6.39966 10.1168 numMergedOcc 0
8 mol 19 unq 1 iso 0 dist 8.59114 4.06798 8.41365 10.8426 6.39966 10.1168 numMergedOcc 0
9 mol 19 unq 2 iso 0 dist 8.63204 15.1867 8.41365 10.5195 6.39966 10.1168 numMergedOcc 0
10 mol 24 unq 0 iso 0 dist 4.61828 5.06937 5.78238 10.7574 9.69752 12.1924 numMergedOcc 0
11 mol 24 unq 1 iso 0 dist 4.61828 5.06937 5.78238 12.8157 9.36461 14.9821 numMergedOcc 0
12 mol 63 unq 0 iso 0 dist 9.16658 13.3077 8.34374 7.8821 5.53589 7.25012 numMergedOcc 0
13 mol 73 unq 0 iso 0 dist 8.91206 6.93186 9.23537 6.41591 7.62738 5.00897 numMergedOcc 0
14 mol 73 unq 1 iso 0 dist 8.67513 7.21044 9.23537 9.55939 7.62738 5.00897 numMergedOcc 0
15 mol 75 unq 0 iso 0 dist 6.59253 4.391 6.13936 6.05353 7.6433 6.21982 numMergedOcc 0
16 mol 126 unq 0 iso 0 dist 7.68174 9.3182 8.8359 8.31794 5.94233 4.43093 numMergedOcc 0
17 mol 126 unq 1 iso 0 dist 7.68174 9.3182 8.8359 9.33341 8.56219 10.6362 numMergedOcc 0
18 mol 135 unq 0 iso 0 dist 5.97971 7.03603 6.80457 11.1112 9.40325 5.14857 numMergedOcc 0
19 mol 135 unq 1 iso 0 dist 5.97971 7.03603 6.80457 6.32401 7.62606 5.26692 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 6.93136 5.73493 6.63984 11.6598 6.95372 9.64692 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 4.97005 13.1124 9.05979 5.80701 7.46987 13.7214 numMergedOcc 0
22 mol 188 unq 0 iso 0 dist 8.8513 5.51595 5.77968 5.20086 5.73306 6.00221 numMergedOcc 0
23 mol 188 unq 1 iso 0 dist 9.53031 4.54544 5.77968 10.4355 5.73306 6.00221 numMergedOcc 0
24 mol 194 unq 0 iso 0 dist 8.63008 15.0013 9.13708 4.44921 5.68348 13.9769 numMergedOcc 0
25 mol 210 unq 0 iso 0 dist 9.05206 9.98896 8.53457 11.9731 5.57779 11.3555 numMergedOcc 0
26 mol 210 unq 1 iso 0 dist 9.05206 9.98896 8.53457 10.4089 7.05649 4.94588 numMergedOcc 0
27 mol 210 unq 2 iso 0 dist 9.05206 9.98896 8.53457 4.78637 6.78579 6.61563 numMergedOcc 0
28 mol 220 unq 0 iso 0 dist 9.3439 14.6366 6.648 9.91189 6.51288 7.31769 numMergedOcc 0
29 mol 266 unq 0 iso 0 dist 9.54884 7.07103 8.7324 10.8812 9.53943 8.19557 numMergedOcc 0
30 mol 272 unq 0 iso 0 dist 7.11691 11.1921 6.49719 8.64133 9.18635 7.70017 numMergedOcc 0
31 mol 272 unq 1 iso 0 dist 7.11691 6.07797 5.7564 8.64133 9.18635 4.49628 numMergedOcc 0
32 mol 279 unq 0 iso 0 dist 8.84798 9.69939 7.92537 10.8394 9.30921 8.23428 numMergedOcc 0
