0 mol 5 unq 0 iso 0 dist 5.04052 7.0627 3.33561 8.35174 7.50453 5.69239 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.87863 8.80355 9.50135 15.05 7.50453 13.6585 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 6.46284 7.62938 5.31713 5.17677 7.74636 7.64769 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 4.61355 9.942 9.44812 4.38299 5.4713 13.7135 numMergedOcc 0
4 mol 46 unq 1 iso 0 dist 4.61355 5.92771 6.08836 4.38299 5.4713 3.77542 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 5.92285 6.42645 5.98227 7.49995 8.93807 4.46067 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 6.22498 7.07055 3.78604 8.0664 9.14801 12.4019 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 8.18122 9.85144 3.3389 8.75597 4.14492 5.36214 numMergedOcc 0
8 mol 123 unq 1 iso 0 dist 8.36221 8.09329 11.5607 7.36026 4.14492 10.7894 numMergedOcc 0
9 mol 123 unq 2 iso 0 dist 8.36221 5.80266 3.3389 7.36026 4.14492 5.36214 numMergedOcc 0
10 mol 123 unq 3 iso 0 dist 8.6441 5.18305 8.42496 6.45068 4.14492 5.56127 numMergedOcc 0
11 mol 123 unq 4 iso 0 dist 8.6441 6.13025 11.5607 6.45068 4.14492 10.7894 numMergedOcc 0
12 mol 123 unq 5 iso 0 dist 8.6441 6.78431 3.3389 6.45068 4.14492 5.36214 numMergedOcc 0
13 mol 123 unq 6 iso 0 dist 6.70684 6.60464 3.3389 6.36283 4.14492 5.36214 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 8.79644 8.80004 3.18152 9.55863 7.65903 5.10589 numMergedOcc 0
15 mol 169 unq 1 iso 0 dist 8.79644 8.80004 3.18152 4.68959 5.97653 4.63336 numMergedOcc 0
16 mol 169 unq 2 iso 0 dist 8.79644 8.80004 3.18152 5.99532 7.75523 6.10715 numMergedOcc 0
17 mol 171 unq 0 iso 0 dist 8.83844 8.25547 7.20382 4.73385 9.68512 10.6564 numMergedOcc 0
18 mol 184 unq 0 iso 0 dist 8.32647 6.03505 11.1533 9.26049 7.25623 14.5761 numMergedOcc 0
19 mol 184 unq 1 iso 0 dist 8.32647 6.30144 3.74437 9.26049 7.25623 8.53111 numMergedOcc 0
20 mol 198 unq 0 iso 0 dist 9.42723 6.49746 3.70259 14.6341 9.75417 11.8178 numMergedOcc 0
21 mol 198 unq 1 iso 0 dist 9.42723 5.8917 5.13258 14.6341 9.75417 13.6867 numMergedOcc 0
22 mol 198 unq 2 iso 0 dist 7.70823 9.70373 3.70259 5.78548 9.75417 11.8178 numMergedOcc 0
23 mol 198 unq 3 iso 0 dist 8.16611 9.76877 3.70259 4.02569 9.75417 11.8178 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 8.9694 6.03628 5.22858 9.12568 8.7434 10.8477 numMergedOcc 0
25 mol 214 unq 1 iso 0 dist 8.02723 9.22105 9.08285 8.77167 8.7434 15.9979 numMergedOcc 0
26 mol 214 unq 2 iso 0 dist 8.70011 7.81831 3.64285 8.36583 7.70062 7.96338 numMergedOcc 0
27 mol 214 unq 3 iso 0 dist 8.70011 7.81831 3.64285 5.61704 7.66702 7.42759 numMergedOcc 0
28 mol 237 unq 0 iso 0 dist 6.16312 5.27463 5.88058 7.05389 9.50001 11.1444 numMergedOcc 0
29 mol 285 unq 0 iso 0 dist 7.63933 6.94666 3.14843 8.56197 4.27826 5.88958 numMergedOcc 0
30 mol 285 unq 1 iso 0 dist 7.63933 6.94666 3.14843 12.7469 5.82074 7.78121 numMergedOcc 0
31 mol 287 unq 0 iso 0 dist 7.74312 8.08382 3.66473 6.1158 4.93516 4.68668 numMergedOcc 0
32 mol 288 unq 0 iso 0 dist 7.74312 8.08382 3.66473 6.1158 4.93516 4.68668 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 7.74312 8.08382 3.66473 6.1158 4.93516 4.68668 numMergedOcc 0
