0 mol 52 unq 0 iso 0 dist 5.95004 8.38301 5.43618 6.30728 9.23654 7.35262 numMergedOcc 0
1 mol 52 unq 0 iso 1 dist 8.38301 5.95004 5.43618 6.30728 7.35262 9.23654 numMergedOcc 0
2 mol 148 unq 0 iso 0 dist 5.34451 9.74966 8.38946 9.14482 7.38002 12.7981 numMergedOcc 0
3 mol 148 unq 0 iso 1 dist 9.74966 5.34451 8.38946 9.14482 12.7981 7.38002 numMergedOcc 0
4 mol 150 unq 0 iso 0 dist 6.6175 9.87914 9.00126 9.08705 8.46302 12.9947 numMergedOcc 0
5 mol 150 unq 0 iso 1 dist 9.87914 6.6175 9.00126 9.08705 12.9947 8.46302 numMergedOcc 0
6 mol 152 unq 0 iso 0 dist 7.99446 7.21636 5.72609 9.04814 5.65279 9.53545 numMergedOcc 0
7 mol 152 unq 0 iso 1 dist 7.21636 7.99446 5.72609 9.04814 9.53545 5.65279 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 9.17063 9.99332 4.5403 9.79941 9.32421 6.71137 numMergedOcc 0
9 mol 173 unq 0 iso 1 dist 9.99332 9.17063 4.5403 9.79941 6.71137 9.32421 numMergedOcc 0
10 mol 173 unq 1 iso 0 dist 9.17063 7.13369 13.1862 9.79941 9.32421 8.51683 numMergedOcc 0
11 mol 173 unq 1 iso 1 dist 7.13369 9.17063 13.1862 9.79941 8.51683 9.32421 numMergedOcc 0
12 mol 173 unq 1 iso 0 dist 9.99332 7.13369 11.2682 9.79941 6.71137 8.51683 numMergedOcc 0
13 mol 173 unq 1 iso 1 dist 7.13369 9.99332 11.2682 9.79941 8.51683 6.71137 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 4.35909 5.77393 8.67658 9.13814 10.149 4.8478 numMergedOcc 0
15 mol 181 unq 0 iso 1 dist 5.77393 4.35909 8.67658 9.13814 4.8478 10.149 numMergedOcc 0
16 mol 211 unq 0 iso 0 dist 9.45365 7.14732 9.23863 8.65518 11.8741 3.60128 numMergedOcc 0
17 mol 211 unq 0 iso 1 dist 7.14732 9.45365 9.23863 8.65518 3.60128 11.8741 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 4.3362 5.51565 5.88344 8.42093 5.80442 6.80972 numMergedOcc 0
19 mol 220 unq 0 iso 1 dist 5.51565 4.3362 5.88344 8.42093 6.80972 5.80442 numMergedOcc 0
20 mol 223 unq 0 iso 0 dist 9.86372 7.70946 4.44825 9.68264 11.4605 9.48092 numMergedOcc 0
21 mol 223 unq 0 iso 1 dist 7.70946 9.86372 4.44825 9.68264 9.48092 11.4605 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 9.92947 7.46044 16.6444 9.71948 6.83328 14.285 numMergedOcc 0
23 mol 224 unq 0 iso 1 dist 7.46044 9.92947 16.6444 9.71948 14.285 6.83328 numMergedOcc 0
24 mol 224 unq 1 iso 0 dist 4.99301 6.36813 6.35724 5.59537 5.29304 6.08152 numMergedOcc 0
25 mol 224 unq 1 iso 1 dist 6.36813 4.99301 6.35724 5.59537 6.08152 5.29304 numMergedOcc 0
26 mol 251 unq 0 iso 0 dist 8.20341 8.65547 5.5032 9.0301 13.2432 10.8499 numMergedOcc 0
27 mol 251 unq 0 iso 1 dist 8.65547 8.20341 5.5032 9.0301 10.8499 13.2432 numMergedOcc 0
28 mol 260 unq 0 iso 0 dist 8.66784 8.3298 5.54154 9.16717 15.508 17.0106 numMergedOcc 0
29 mol 260 unq 0 iso 1 dist 8.3298 8.66784 5.54154 9.16717 17.0106 15.508 numMergedOcc 0
30 mol 274 unq 0 iso 0 dist 9.96645 9.29005 19.0649 8.44743 5.84383 16.9961 numMergedOcc 0
31 mol 274 unq 0 iso 1 dist 9.29005 9.96645 19.0649 8.44743 16.9961 5.84383 numMergedOcc 0
32 mol 274 unq 1 iso 0 dist 9.96645 8.16746 17.8293 8.44743 5.84383 14.6393 numMergedOcc 0
33 mol 274 unq 1 iso 1 dist 8.16746 9.96645 17.8293 8.44743 14.6393 5.84383 numMergedOcc 0
34 mol 274 unq 1 iso 0 dist 9.29005 8.16746 5.09461 8.44743 16.9961 14.6393 numMergedOcc 0
35 mol 274 unq 1 iso 1 dist 8.16746 9.29005 5.09461 8.44743 14.6393 16.9961 numMergedOcc 0
36 mol 277 unq 0 iso 0 dist 8.83777 9.42812 11.4925 7.7537 15.2536 15.5593 numMergedOcc 0
37 mol 277 unq 0 iso 1 dist 9.42812 8.83777 11.4925 7.7537 15.5593 15.2536 numMergedOcc 0
