0 mol 58 unq 0 iso 0 dist 7.93406 7.71984 7.84983 4.67517 9.56737 4.81926 numMergedOcc 0
1 mol 58 unq 0 iso 1 dist 7.93406 4.67517 9.56737 7.71984 7.84983 4.81926 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 8.00221 4.23724 6.6003 9.75948 6.44118 5.87491 numMergedOcc 0
3 mol 64 unq 0 iso 1 dist 8.00221 9.75948 6.44118 4.23724 6.6003 5.87491 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 8.44831 11.1263 9.90199 14.5558 9.74996 14.3033 numMergedOcc 0
5 mol 69 unq 0 iso 1 dist 8.44831 14.5558 9.74996 11.1263 9.90199 14.3033 numMergedOcc 0
6 mol 69 unq 1 iso 0 dist 8.44831 11.1263 9.90199 6.01896 8.21667 9.1127 numMergedOcc 0
7 mol 69 unq 1 iso 1 dist 8.44831 6.01896 8.21667 11.1263 9.90199 9.1127 numMergedOcc 0
8 mol 69 unq 1 iso 0 dist 8.44831 14.5558 9.74996 6.01896 8.21667 10.149 numMergedOcc 0
9 mol 69 unq 1 iso 1 dist 8.44831 6.01896 8.21667 14.5558 9.74996 10.149 numMergedOcc 0
10 mol 89 unq 0 iso 0 dist 8.45308 4.4691 9.58625 8.3977 6.36021 6.50464 numMergedOcc 0
11 mol 89 unq 0 iso 1 dist 8.45308 8.3977 6.36021 4.4691 9.58625 6.50464 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 7.28942 15.3149 9.59261 6.69791 6.67936 10.6225 numMergedOcc 0
13 mol 98 unq 0 iso 1 dist 7.28942 6.69791 6.67936 15.3149 9.59261 10.6225 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 7.28942 15.3149 9.59261 10.9221 8.25817 12.7411 numMergedOcc 0
15 mol 98 unq 1 iso 1 dist 7.28942 10.9221 8.25817 15.3149 9.59261 12.7411 numMergedOcc 0
16 mol 98 unq 1 iso 0 dist 7.28942 6.69791 6.67936 10.9221 8.25817 7.72877 numMergedOcc 0
17 mol 98 unq 1 iso 1 dist 7.28942 10.9221 8.25817 6.69791 6.67936 7.72877 numMergedOcc 0
18 mol 110 unq 0 iso 0 dist 7.1891 7.92629 7.21229 4.65767 5.25492 4.56913 numMergedOcc 0
19 mol 110 unq 0 iso 1 dist 7.1891 4.65767 5.25492 7.92629 7.21229 4.56913 numMergedOcc 0
20 mol 110 unq 1 iso 0 dist 7.67702 9.86374 7.21229 5.33778 5.25492 4.56913 numMergedOcc 0
21 mol 110 unq 1 iso 1 dist 7.67702 5.33778 5.25492 9.86374 7.21229 4.56913 numMergedOcc 0
22 mol 126 unq 0 iso 0 dist 9.50807 5.81216 7.11388 10.9837 8.83131 9.97817 numMergedOcc 0
23 mol 126 unq 0 iso 1 dist 9.50807 10.9837 8.83131 5.81216 7.11388 9.97817 numMergedOcc 0
24 mol 175 unq 0 iso 0 dist 8.12739 8.65331 9.57611 6.87887 5.08206 9.24932 numMergedOcc 0
25 mol 175 unq 0 iso 1 dist 8.12739 6.87887 5.08206 8.65331 9.57611 9.24932 numMergedOcc 0
26 mol 234 unq 0 iso 0 dist 9.5831 11.5103 5.89084 4.98993 8.47009 7.82322 numMergedOcc 0
27 mol 234 unq 0 iso 1 dist 9.5831 4.98993 8.47009 11.5103 5.89084 7.82322 numMergedOcc 0
28 mol 238 unq 0 iso 0 dist 5.59164 5.77573 6.83152 4.67735 5.24313 5.42006 numMergedOcc 0
29 mol 238 unq 0 iso 1 dist 5.59164 4.67735 5.24313 5.77573 6.83152 5.42006 numMergedOcc 0
30 mol 249 unq 0 iso 0 dist 8.9281 5.0425 5.78121 12.6924 7.29898 8.34718 numMergedOcc 0
31 mol 249 unq 0 iso 1 dist 8.9281 12.6924 7.29898 5.0425 5.78121 8.34718 numMergedOcc 0
32 mol 264 unq 0 iso 0 dist 9.23807 5.0006 9.01085 7.59549 6.28512 5.57311 numMergedOcc 0
33 mol 264 unq 0 iso 1 dist 9.23807 7.59549 6.28512 5.0006 9.01085 5.57311 numMergedOcc 0
34 mol 264 unq 1 iso 0 dist 8.49619 12.0886 9.01085 7.58851 6.28512 5.57311 numMergedOcc 0
35 mol 264 unq 1 iso 1 dist 8.49619 7.58851 6.28512 12.0886 9.01085 5.57311 numMergedOcc 0
