0 mol 17 unq 0 iso 0 dist 8.04682 6.25587 3.85023 4.67638 10.097 7.25951 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 8.04682 6.25587 3.85023 10.6511 11.0717 7.92012 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 8.6615 9.28637 3.61632 13.5841 9.39331 5.86181 numMergedOcc 0
3 mol 20 unq 1 iso 0 dist 8.6615 9.28637 3.61632 4.14121 6.86736 6.3253 numMergedOcc 0
4 mol 20 unq 2 iso 0 dist 8.6615 9.28637 3.61632 11.667 8.17383 5.80568 numMergedOcc 0
5 mol 32 unq 0 iso 0 dist 8.73001 5.78878 10.0199 5.49317 13.3264 8.5315 numMergedOcc 0
6 mol 53 unq 0 iso 0 dist 6.78966 6.81867 5.21227 9.52412 10.2553 8.94227 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 7.52639 7.54919 8.86585 11.0544 10.8404 6.78004 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 8.50394 9.12912 8.86585 9.66523 10.8404 6.78004 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 5.6738 5.7085 8.69658 5.03181 10.3416 6.6317 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 6.07578 6.08141 7.86006 9.13275 8.619 5.25109 numMergedOcc 0
11 mol 171 unq 1 iso 0 dist 6.07578 6.08141 7.86006 11.3808 11.7943 8.21618 numMergedOcc 0
12 mol 192 unq 0 iso 0 dist 5.25555 5.64003 3.72014 6.03369 5.47004 8.26288 numMergedOcc 0
13 mol 196 unq 0 iso 0 dist 6.23804 4.83135 3.68546 4.45798 9.37223 7.21349 numMergedOcc 0
14 mol 196 unq 1 iso 0 dist 6.66019 4.83135 6.56216 4.45798 10.809 7.21349 numMergedOcc 0
15 mol 196 unq 2 iso 0 dist 9.88671 4.83135 7.25762 4.45798 13.195 7.21349 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 7.68603 8.70651 6.25229 14.8728 12.9677 9.78181 numMergedOcc 0
17 mol 232 unq 1 iso 0 dist 7.68603 8.70651 6.25229 4.03628 6.02641 9.8664 numMergedOcc 0
18 mol 265 unq 0 iso 0 dist 6.52552 6.99454 10.3547 8.9809 15.4092 8.984 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 7.57543 6.99089 8.70836 4.82331 11.6402 7.00243 numMergedOcc 0
20 mol 266 unq 1 iso 0 dist 8.55542 6.99089 12.6333 4.82331 11.3494 7.00243 numMergedOcc 0
21 mol 266 unq 2 iso 0 dist 8.93788 6.99089 14.63 4.82331 9.60449 7.00243 numMergedOcc 0
