0 mol 1 unq 0 iso 0 dist 8.78392 5.54135 9.00903 4.68612 8.56884 9.01967 numMergedOcc 0
1 mol 45 unq 0 iso 0 dist 7.84098 10.9752 7.2846 6.4953 6.34173 4.71384 numMergedOcc 0
2 mol 45 unq 1 iso 0 dist 7.84098 5.97638 7.58835 6.4953 6.34173 5.67689 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 6.71137 6.56803 6.85766 5.96296 6.71911 7.29033 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 6.71137 4.50067 7.71095 5.96296 6.71911 5.33688 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 7.10826 13.0428 9.38498 14.7989 8.70133 13.4082 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 7.10826 12.5046 9.96396 14.7989 8.70133 7.41074 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 7.10826 4.51799 9.75218 14.7989 8.70133 15.9882 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 9.21974 4.98767 7.47541 11.1821 7.22293 7.98917 numMergedOcc 0
9 mol 85 unq 1 iso 0 dist 9.21974 7.47375 7.66905 11.1821 7.22293 11.6116 numMergedOcc 0
10 mol 85 unq 2 iso 0 dist 9.21974 6.7801 5.73196 11.1821 7.22293 6.47779 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 7.92708 4.43203 9.60661 11.5994 6.58204 10.9608 numMergedOcc 0
12 mol 100 unq 1 iso 0 dist 7.92708 12.5527 7.17106 11.5994 6.58204 5.01145 numMergedOcc 0
13 mol 100 unq 2 iso 0 dist 7.92708 9.84997 9.35224 11.5994 6.58204 5.69137 numMergedOcc 0
14 mol 100 unq 3 iso 0 dist 5.1385 5.96628 7.47343 11.5994 7.75343 15.209 numMergedOcc 0
15 mol 100 unq 4 iso 0 dist 5.1385 4.43203 6.65086 11.5994 7.75343 10.9608 numMergedOcc 0
16 mol 100 unq 5 iso 0 dist 5.1385 9.84997 6.56369 11.5994 7.75343 5.69137 numMergedOcc 0
17 mol 100 unq 6 iso 0 dist 5.1385 9.21424 9.30209 11.5994 7.75343 9.21622 numMergedOcc 0
18 mol 100 unq 7 iso 0 dist 4.86758 9.60547 6.45675 13.5255 8.72704 7.2495 numMergedOcc 0
19 mol 100 unq 8 iso 0 dist 4.86758 9.59578 7.47343 13.5255 8.72704 10.1589 numMergedOcc 0
20 mol 100 unq 9 iso 0 dist 4.86758 5.92453 8.86688 13.5255 8.72704 15.9331 numMergedOcc 0
21 mol 114 unq 0 iso 0 dist 9.46144 8.56349 7.5732 7.04769 8.71128 5.80557 numMergedOcc 0
22 mol 114 unq 1 iso 0 dist 9.66471 11.3857 7.35754 7.04769 7.52743 4.77056 numMergedOcc 0
23 mol 117 unq 0 iso 0 dist 8.08241 8.25965 9.84395 10.0618 6.62561 11.3679 numMergedOcc 0
24 mol 117 unq 1 iso 0 dist 8.08241 13.9096 7.90328 10.0618 6.62561 4.91401 numMergedOcc 0
25 mol 131 unq 0 iso 0 dist 7.30166 7.3338 7.12972 5.2907 8.6243 6.19596 numMergedOcc 0
26 mol 131 unq 1 iso 0 dist 9.82508 7.3338 6.85062 5.2907 6.91348 6.19596 numMergedOcc 0
27 mol 131 unq 2 iso 0 dist 9.82508 7.3338 6.85062 13.4046 9.51418 6.6499 numMergedOcc 0
28 mol 132 unq 0 iso 0 dist 7.41216 7.25384 7.7059 4.18391 6.03703 9.92344 numMergedOcc 0
29 mol 175 unq 0 iso 0 dist 9.91541 9.97933 9.29945 13.2417 9.52634 9.11521 numMergedOcc 0
