0 mol 4 unq 0 iso 0 dist 5.51567 4.83806 7.77633 6.1326 8.68164 7.02535 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 9.22796 5.86427 7.61139 10.4896 7.99756 4.8515 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.45916 17.1139 9.03541 13.4799 8.85286 12.2619 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 8.63743 13.0605 7.95815 9.95772 8.29196 6.29782 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 9.78762 9.553 9.3711 7.24635 5.45099 10.1475 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 9.78762 9.553 9.3711 8.05782 8.44765 4.4828 numMergedOcc 0
6 mol 76 unq 2 iso 0 dist 9.78762 9.553 9.3711 12.4827 9.06643 7.00476 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 9.71043 4.54789 8.89939 6.89822 9.54696 5.92952 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 9.71043 4.54789 8.89939 10.9616 4.62636 9.79253 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 6.10658 5.65741 4.33805 6.27339 7.56563 4.20944 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 7.12029 4.83829 9.82338 7.93285 9.17458 5.56574 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 7.12029 4.83829 9.82338 8.70013 7.36794 7.76011 numMergedOcc 0
12 mol 186 unq 2 iso 0 dist 8.56602 4.83829 7.99933 7.93285 6.94594 5.56574 numMergedOcc 0
13 mol 186 unq 3 iso 0 dist 8.56602 4.83829 7.99933 8.70013 5.81881 7.76011 numMergedOcc 0
14 mol 194 unq 0 iso 0 dist 9.26885 4.99222 9.51368 5.30387 6.68939 4.31516 numMergedOcc 0
15 mol 207 unq 0 iso 0 dist 9.93721 11.5669 6.06003 6.78639 7.30153 8.77108 numMergedOcc 0
16 mol 207 unq 1 iso 0 dist 6.29106 4.85991 6.06003 6.22421 7.30153 8.77108 numMergedOcc 0
17 mol 217 unq 0 iso 0 dist 4.92885 9.5885 8.46235 4.84502 6.19602 8.92326 numMergedOcc 0
18 mol 217 unq 1 iso 0 dist 4.92885 7.36436 5.27487 4.84502 6.19602 4.90493 numMergedOcc 0
19 mol 222 unq 0 iso 0 dist 8.51427 10.6493 5.07975 9.2281 8.88902 12.2754 numMergedOcc 0
20 mol 228 unq 0 iso 0 dist 9.96994 4.95664 9.94849 11.1565 9.06403 13.1297 numMergedOcc 0
21 mol 260 unq 0 iso 0 dist 8.01717 5.67835 7.88296 13.2373 9.73217 13.6008 numMergedOcc 0
22 mol 279 unq 0 iso 0 dist 9.44618 4.07526 8.16952 11.096 8.62266 7.53916 numMergedOcc 0
23 mol 279 unq 1 iso 0 dist 9.44618 6.45021 9.67649 11.096 8.62266 12.077 numMergedOcc 0
24 mol 285 unq 0 iso 0 dist 9.26793 18.1671 9.30058 12.0007 4.27826 9.74601 numMergedOcc 0
25 mol 285 unq 1 iso 0 dist 9.26793 18.1671 9.30058 15.0759 5.82074 5.04155 numMergedOcc 0
26 mol 285 unq 2 iso 0 dist 9.26793 14.2829 6.5354 12.0007 4.27826 4.31553 numMergedOcc 0
27 mol 285 unq 3 iso 0 dist 9.26793 14.2829 6.5354 15.0759 5.82074 5.02414 numMergedOcc 0
