0 mol 32 unq 0 iso 0 dist 8.72278 8.19716 7.6082 9.88342 5.07106 7.66677 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 8.72278 8.19716 7.6082 8.14778 4.92166 10.2379 numMergedOcc 0
2 mol 32 unq 2 iso 0 dist 8.72278 5.05941 4.09276 9.88342 5.07106 5.46097 numMergedOcc 0
3 mol 32 unq 3 iso 0 dist 8.72278 5.05941 4.09276 8.14778 4.92166 5.27549 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 7.55854 12.2035 7.52915 5.37112 9.14072 14.4289 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 5.48669 6.97305 7.52915 8.94459 9.14072 14.4289 numMergedOcc 0
6 mol 48 unq 2 iso 0 dist 5.78051 5.43732 7.52915 9.49743 9.14072 14.4289 numMergedOcc 0
7 mol 173 unq 0 iso 0 dist 8.91036 9.62833 9.9855 14.4364 6.60418 10.5283 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 7.83389 5.56525 9.9224 6.22575 5.21088 8.02909 numMergedOcc 0
9 mol 192 unq 1 iso 0 dist 7.83389 5.56525 9.9224 14.4767 9.78743 12.1423 numMergedOcc 0
10 mol 192 unq 2 iso 0 dist 7.83389 5.56525 9.9224 6.95862 8.25609 12.357 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 9.78043 12.7397 9.39697 10.9934 9.35664 5.87625 numMergedOcc 0
12 mol 195 unq 1 iso 0 dist 9.78043 5.06646 4.86882 10.9934 9.35664 8.32665 numMergedOcc 0
13 mol 212 unq 0 iso 0 dist 7.35349 5.09611 9.74234 6.60813 7.27225 4.72503 numMergedOcc 0
14 mol 241 unq 0 iso 0 dist 9.23127 3.96997 7.44279 7.33716 8.48816 4.91384 numMergedOcc 0
15 mol 241 unq 1 iso 0 dist 9.23127 3.96997 7.44279 6.05658 9.8198 4.58996 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 9.44043 6.69333 5.53473 11.1283 5.9223 7.85663 numMergedOcc 0
17 mol 258 unq 1 iso 0 dist 5.3435 8.08381 5.53473 11.1483 5.9223 7.85663 numMergedOcc 0
18 mol 258 unq 2 iso 0 dist 8.28364 7.8177 5.53473 13.5253 5.9223 7.85663 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 5.83023 4.09948 9.027 4.69901 8.99435 7.20929 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 8.40448 12.5049 7.67032 10.7979 9.73763 4.8694 numMergedOcc 0
