0 mol 36 unq 0 iso 0 dist 9.98689 6.76635 8.47497 5.48957 8.71538 4.03332 numMergedOcc 0
1 mol 123 unq 0 iso 0 dist 7.76707 8.37794 9.86842 4.48885 8.40918 4.42208 numMergedOcc 0
2 mol 123 unq 1 iso 0 dist 7.63425 12.9585 9.86842 9.67707 8.40918 4.42208 numMergedOcc 0
3 mol 126 unq 0 iso 0 dist 7.80819 4.30864 7.25133 4.41415 5.78493 4.32945 numMergedOcc 0
4 mol 157 unq 0 iso 0 dist 6.66184 6.754 9.668 4.15636 8.36016 7.72329 numMergedOcc 0
5 mol 167 unq 0 iso 0 dist 6.6514 10.8805 9.82329 4.0116 8.43955 9.16459 numMergedOcc 0
6 mol 184 unq 0 iso 0 dist 9.0757 16.3549 9.45847 13.3585 8.5544 15.8504 numMergedOcc 0
7 mol 184 unq 1 iso 0 dist 9.0757 6.55123 7.895 13.3585 8.5544 8.94646 numMergedOcc 0
8 mol 184 unq 2 iso 0 dist 9.39563 3.95306 9.45847 13.6612 8.5544 15.8504 numMergedOcc 0
9 mol 184 unq 3 iso 0 dist 9.39563 17.0877 7.895 13.6612 8.5544 8.94646 numMergedOcc 0
10 mol 184 unq 4 iso 0 dist 7.51045 9.14602 9.45847 9.09295 8.5544 15.8504 numMergedOcc 0
11 mol 184 unq 5 iso 0 dist 7.51045 13.1965 7.895 9.09295 8.5544 8.94646 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.98221 13.6469 9.08767 8.57203 5.97886 11.6447 numMergedOcc 0
13 mol 204 unq 0 iso 0 dist 4.90334 6.42715 7.00683 5.96019 9.41594 4.96901 numMergedOcc 0
14 mol 204 unq 1 iso 0 dist 4.90334 6.42715 7.00683 8.84143 9.92651 3.72258 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 5.12798 7.70847 9.81136 5.87613 9.59498 9.67136 numMergedOcc 0
16 mol 214 unq 1 iso 0 dist 5.12798 6.52672 7.25293 5.87613 9.59498 4.99827 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 7.19924 15.6809 9.09835 12.6063 8.99104 12.64 numMergedOcc 0
18 mol 239 unq 1 iso 0 dist 7.19924 12.3037 7.21466 12.6063 8.99104 10.3384 numMergedOcc 0
19 mol 254 unq 0 iso 0 dist 9.26382 12.2374 7.53352 5.87303 8.30975 9.97794 numMergedOcc 0
20 mol 254 unq 1 iso 0 dist 9.26382 12.2374 7.53352 9.70964 8.10036 9.08435 numMergedOcc 0
21 mol 254 unq 2 iso 0 dist 9.26382 12.2374 7.53352 17.1068 8.96529 13.2196 numMergedOcc 0
22 mol 254 unq 3 iso 0 dist 9.26382 8.99253 7.80793 5.87303 8.30975 4.69026 numMergedOcc 0
23 mol 254 unq 4 iso 0 dist 9.26382 8.99253 7.80793 9.70964 8.10036 4.10825 numMergedOcc 0
24 mol 254 unq 5 iso 0 dist 9.26382 8.99253 7.80793 17.1068 8.96529 13.4679 numMergedOcc 0
25 mol 254 unq 6 iso 0 dist 9.73281 14.9316 7.53352 10.2805 8.30975 9.97794 numMergedOcc 0
26 mol 254 unq 7 iso 0 dist 9.73281 14.9316 7.53352 13.3352 8.10036 9.08435 numMergedOcc 0
27 mol 254 unq 8 iso 0 dist 9.73281 14.9316 7.53352 17.1208 8.96529 13.2196 numMergedOcc 0
28 mol 254 unq 9 iso 0 dist 9.73281 13.1153 7.80793 10.2805 8.30975 4.69026 numMergedOcc 0
29 mol 254 unq 10 iso 0 dist 9.73281 13.1153 7.80793 13.3352 8.10036 4.10825 numMergedOcc 0
30 mol 254 unq 11 iso 0 dist 9.73281 13.1153 7.80793 17.1208 8.96529 13.4679 numMergedOcc 0
31 mol 266 unq 0 iso 0 dist 9.64366 5.89487 6.91743 6.21107 9.80672 3.60985 numMergedOcc 0
32 mol 266 unq 1 iso 0 dist 9.64366 5.89487 6.91743 6.71682 9.26882 5.9856 numMergedOcc 0
33 mol 266 unq 2 iso 0 dist 9.64366 5.89487 6.91743 3.49423 9.38539 4.90674 numMergedOcc 0
