0 mol 26 unq 0 iso 0 dist 6.25761 5.03531 6.00253 13.6936 8.65828 12.4336 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 6.09309 4.49593 5.83388 7.17655 5.87633 9.28621 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 6.09309 4.49593 5.83388 5.80563 7.09381 8.36195 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 8.06419 8.6127 11.7849 5.56904 6.30436 11.558 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 8.06419 9.25005 12.5711 5.56904 6.30436 13.5529 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 8.85672 9.12204 12.0802 4.86646 9.96522 11.9682 numMergedOcc 0
6 mol 54 unq 1 iso 0 dist 7.34695 7.18148 13.1197 9.34149 6.29755 15.3045 numMergedOcc 0
7 mol 54 unq 2 iso 0 dist 7.34695 7.18148 13.1197 13.5048 7.4038 19.1169 numMergedOcc 0
8 mol 99 unq 0 iso 0 dist 7.55911 5.43108 9.92636 13.3825 9.39801 16.8635 numMergedOcc 0
9 mol 99 unq 1 iso 0 dist 7.55911 5.43108 9.92636 6.06914 4.82346 10.6842 numMergedOcc 0
10 mol 99 unq 2 iso 0 dist 7.55911 5.43108 9.92636 6.72932 8.89165 12.1397 numMergedOcc 0
11 mol 165 unq 0 iso 0 dist 7.29604 6.74196 11.0913 8.4352 7.8052 10.5145 numMergedOcc 0
12 mol 165 unq 1 iso 0 dist 7.29604 6.74196 11.0913 9.88989 8.20329 14.2723 numMergedOcc 0
13 mol 165 unq 2 iso 0 dist 9.21329 6.72652 11.0913 5.73847 7.8052 10.5145 numMergedOcc 0
14 mol 165 unq 3 iso 0 dist 9.21329 6.72652 11.0913 8.51209 8.20329 14.2723 numMergedOcc 0
15 mol 165 unq 4 iso 0 dist 9.21329 6.4503 11.4281 5.73847 7.8052 8.00005 numMergedOcc 0
16 mol 165 unq 5 iso 0 dist 9.21329 6.4503 11.4281 8.51209 8.20329 12.7048 numMergedOcc 0
17 mol 184 unq 0 iso 0 dist 6.66619 9.15923 10.5517 9.52044 8.49577 17.4487 numMergedOcc 0
18 mol 184 unq 1 iso 0 dist 6.66619 7.79098 6.53883 9.52044 8.49577 13.8702 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 5.42362 9.59909 6.93198 4.44329 9.01742 13.0534 numMergedOcc 0
20 mol 250 unq 0 iso 0 dist 6.28288 8.45998 6.97122 4.11548 8.59384 11.3769 numMergedOcc 0
21 mol 269 unq 0 iso 0 dist 8.38513 6.53779 4.89258 11.6414 7.76667 9.20068 numMergedOcc 0
22 mol 269 unq 1 iso 0 dist 7.7144 6.02501 4.89258 7.49114 7.76667 9.20068 numMergedOcc 0
23 mol 282 unq 0 iso 0 dist 9.46797 9.02882 9.10431 9.68952 8.30313 15.3584 numMergedOcc 0
24 mol 282 unq 1 iso 0 dist 9.46797 9.02882 9.10431 9.51582 6.51248 13.1317 numMergedOcc 0
