0 mol 5 unq 0 iso 0 dist 5.04052 8.35174 7.50453 7.0627 3.33561 5.69239 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.87863 15.05 7.50453 12.1228 3.33561 5.69239 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 6.46284 5.17677 7.74636 7.62938 5.31713 7.64769 numMergedOcc 0
3 mol 5 unq 3 iso 0 dist 6.46284 5.17677 7.74636 10.7685 7.84244 8.31759 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 4.61355 4.38299 5.4713 5.92771 6.08836 3.77542 numMergedOcc 0
5 mol 46 unq 1 iso 0 dist 4.61355 4.38299 5.4713 10.7473 14.1986 9.97314 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 5.92285 7.49995 8.93807 6.42645 5.98227 4.46067 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 8.18122 8.75597 4.14492 14.2713 8.42496 5.56127 numMergedOcc 0
8 mol 123 unq 1 iso 0 dist 8.18122 8.75597 4.14492 11.3337 10.3919 8.03692 numMergedOcc 0
9 mol 123 unq 2 iso 0 dist 8.18122 8.75597 4.14492 9.85144 3.3389 5.36214 numMergedOcc 0
10 mol 123 unq 3 iso 0 dist 8.36221 7.36026 4.14492 8.39986 8.42496 5.56127 numMergedOcc 0
11 mol 123 unq 4 iso 0 dist 8.36221 7.36026 4.14492 15.0739 10.3919 8.03692 numMergedOcc 0
12 mol 123 unq 5 iso 0 dist 8.36221 7.36026 4.14492 5.80266 3.3389 5.36214 numMergedOcc 0
13 mol 123 unq 6 iso 0 dist 8.6441 6.45068 4.14492 5.18305 8.42496 5.56127 numMergedOcc 0
14 mol 123 unq 7 iso 0 dist 8.6441 6.45068 4.14492 13.4965 10.3919 8.03692 numMergedOcc 0
15 mol 123 unq 8 iso 0 dist 8.6441 6.45068 4.14492 6.78431 3.3389 5.36214 numMergedOcc 0
16 mol 123 unq 9 iso 0 dist 6.70684 6.36283 4.14492 11.0811 8.42496 5.56127 numMergedOcc 0
17 mol 123 unq 10 iso 0 dist 6.70684 6.36283 4.14492 12.2214 10.3919 8.03692 numMergedOcc 0
18 mol 123 unq 11 iso 0 dist 6.70684 6.36283 4.14492 6.60464 3.3389 5.36214 numMergedOcc 0
19 mol 169 unq 0 iso 0 dist 8.79644 9.55863 7.65903 8.80004 3.18152 5.10589 numMergedOcc 0
20 mol 169 unq 1 iso 0 dist 8.79644 4.68959 5.97653 8.80004 3.18152 4.63336 numMergedOcc 0
21 mol 169 unq 2 iso 0 dist 8.79644 5.99532 7.75523 8.80004 3.18152 6.10715 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 8.70011 8.36583 7.70062 14.6179 7.87816 8.66082 numMergedOcc 0
23 mol 214 unq 1 iso 0 dist 8.70011 8.36583 7.70062 7.81831 3.64285 7.96338 numMergedOcc 0
24 mol 214 unq 2 iso 0 dist 8.70011 5.61704 7.66702 7.81831 3.64285 7.42759 numMergedOcc 0
25 mol 285 unq 0 iso 0 dist 7.63933 8.56197 4.27826 6.94666 3.14843 5.88958 numMergedOcc 0
26 mol 285 unq 1 iso 0 dist 7.63933 12.7469 5.82074 6.94666 3.14843 7.78121 numMergedOcc 0
27 mol 287 unq 0 iso 0 dist 7.74312 6.1158 4.93516 8.08382 3.66473 4.68668 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 7.74312 6.1158 4.93516 8.08382 3.66473 4.68668 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 7.74312 6.1158 4.93516 8.08382 3.66473 4.68668 numMergedOcc 0
