0 mol 48 unq 0 iso 0 dist 8.69823 6.59044 5.73454 12.3053 5.69576 7.78518 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 5.20528 3.93024 6.46549 8.58689 6.64001 8.87977 numMergedOcc 0
2 mol 85 unq 1 iso 0 dist 5.20528 3.93024 6.46549 7.82214 4.58085 9.43843 numMergedOcc 0
3 mol 113 unq 0 iso 0 dist 8.49444 6.04365 7.40338 11.8765 8.69658 8.46167 numMergedOcc 0
4 mol 113 unq 1 iso 0 dist 5.55446 6.04365 6.23759 11.8765 11.1416 8.46167 numMergedOcc 0
5 mol 131 unq 0 iso 0 dist 9.63085 7.75948 7.84546 9.96357 5.06665 9.8911 numMergedOcc 0
6 mol 131 unq 1 iso 0 dist 9.63085 7.75948 7.84546 11.4123 7.7998 7.02043 numMergedOcc 0
7 mol 135 unq 0 iso 0 dist 5.95344 10.9982 7.02963 16.7043 11.7342 7.74087 numMergedOcc 0
8 mol 135 unq 1 iso 0 dist 7.8687 8.95563 7.02963 16.2026 11.7342 7.74087 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 5.53978 11.4948 6.90583 10.4705 6.30849 4.70342 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 5.53978 4.98187 6.75593 10.4705 6.30849 8.23543 numMergedOcc 0
11 mol 169 unq 0 iso 0 dist 9.03552 6.399 7.85698 14.4889 8.16591 9.39809 numMergedOcc 0
12 mol 169 unq 1 iso 0 dist 5.77897 6.399 6.35799 14.4889 10.2799 9.39809 numMergedOcc 0
13 mol 169 unq 2 iso 0 dist 8.59976 15.445 7.85698 16.0714 8.16591 9.39809 numMergedOcc 0
14 mol 169 unq 3 iso 0 dist 9.71763 15.445 6.35799 16.0714 10.2799 9.39809 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 6.71675 9.24858 7.02762 11.9579 5.9935 8.93083 numMergedOcc 0
16 mol 184 unq 1 iso 0 dist 6.71675 9.24858 7.02762 10.9498 8.11291 5.62851 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 8.41708 9.15827 8.72743 7.87925 4.04186 9.64977 numMergedOcc 0
18 mol 197 unq 0 iso 0 dist 9.3055 5.15513 9.15715 6.18166 5.47413 9.10527 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 6.32542 3.30102 5.59832 10.7382 9.6084 8.42716 numMergedOcc 0
20 mol 205 unq 1 iso 0 dist 6.32542 3.30102 5.59832 6.254 8.16279 5.69652 numMergedOcc 0
21 mol 217 unq 0 iso 0 dist 5.88992 5.14513 8.4493 8.57319 9.12199 9.04156 numMergedOcc 0
22 mol 217 unq 1 iso 0 dist 5.19677 5.58323 8.4493 11.3518 9.12199 9.04156 numMergedOcc 0
23 mol 217 unq 2 iso 0 dist 8.94906 10.2049 8.4493 15.5859 9.12199 9.04156 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 7.64361 7.69413 6.23115 13.1751 11.7543 6.12608 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 8.25538 12.1947 7.99204 12.6727 5.41757 8.70479 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 8.25538 12.1947 7.99204 12.6727 5.41757 8.70479 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 8.25538 12.1947 7.99204 12.6727 5.41757 8.70479 numMergedOcc 0
