0 mol 5 unq 0 iso 0 dist 7.0627 8.35174 5.69239 5.04052 3.33561 7.50453 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 7.62938 5.17677 7.64769 6.46284 5.31713 7.74636 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 7.62938 5.58988 9.70883 11.999 13.2371 8.34817 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 5.92771 4.38299 3.77542 4.61355 6.08836 5.4713 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 6.42645 7.49995 4.46067 5.92285 5.98227 8.93807 numMergedOcc 0
5 mol 123 unq 0 iso 0 dist 9.85144 8.75597 5.36214 8.18122 3.3389 4.14492 numMergedOcc 0
6 mol 123 unq 1 iso 0 dist 5.80266 7.36026 5.36214 8.36221 3.3389 4.14492 numMergedOcc 0
7 mol 123 unq 2 iso 0 dist 5.18305 6.45068 5.56127 8.6441 8.42496 4.14492 numMergedOcc 0
8 mol 123 unq 3 iso 0 dist 6.78431 6.45068 5.36214 8.6441 3.3389 4.14492 numMergedOcc 0
9 mol 123 unq 4 iso 0 dist 6.60464 6.36283 5.36214 6.70684 3.3389 4.14492 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 8.72521 10.1404 4.3855 13.148 5.94217 6.60366 numMergedOcc 0
11 mol 169 unq 0 iso 0 dist 9.03941 9.52806 5.10589 17.7032 9.60496 8.6961 numMergedOcc 0
12 mol 169 unq 1 iso 0 dist 8.80004 9.55863 5.10589 8.79644 3.18152 7.65903 numMergedOcc 0
13 mol 169 unq 2 iso 0 dist 8.80004 4.68959 4.63336 8.79644 3.18152 5.97653 numMergedOcc 0
14 mol 169 unq 3 iso 0 dist 8.80004 5.99532 6.10715 8.79644 3.18152 7.75523 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 7.00278 6.46602 8.32259 9.58463 5.80328 8.23717 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 7.00278 8.23616 9.93489 9.58463 5.80328 7.98864 numMergedOcc 0
17 mol 204 unq 2 iso 0 dist 8.50234 8.70089 8.54737 9.63166 3.68217 8.23717 numMergedOcc 0
18 mol 204 unq 3 iso 0 dist 8.50234 5.77393 7.64057 9.63166 3.68217 7.98864 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 7.81831 8.36583 7.96338 13.9749 8.88633 9.59928 numMergedOcc 0
20 mol 214 unq 1 iso 0 dist 7.81831 8.36583 7.96338 8.70011 3.64285 7.70062 numMergedOcc 0
21 mol 214 unq 2 iso 0 dist 7.81831 5.61704 7.42759 8.70011 3.64285 7.66702 numMergedOcc 0
22 mol 260 unq 0 iso 0 dist 8.56451 5.45648 7.04263 12.6081 8.22506 8.51564 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 9.02396 5.11028 7.8598 10.0829 3.14784 7.72861 numMergedOcc 0
24 mol 266 unq 1 iso 0 dist 9.02396 15.2885 8.25286 10.0829 3.14784 8.20376 numMergedOcc 0
25 mol 266 unq 2 iso 0 dist 7.48115 5.11028 7.80711 10.0829 5.95721 7.72861 numMergedOcc 0
26 mol 266 unq 3 iso 0 dist 7.48115 15.2885 9.9965 10.0829 5.95721 8.20376 numMergedOcc 0
27 mol 277 unq 0 iso 0 dist 9.00122 16.3502 7.98956 18.772 10.5214 5.13533 numMergedOcc 0
28 mol 285 unq 0 iso 0 dist 6.94666 8.56197 5.88958 7.63933 3.14843 4.27826 numMergedOcc 0
29 mol 285 unq 1 iso 0 dist 6.94666 12.7469 7.78121 7.63933 3.14843 5.82074 numMergedOcc 0
30 mol 287 unq 0 iso 0 dist 8.08382 6.1158 4.68668 7.74312 3.66473 4.93516 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 8.08382 6.1158 4.68668 7.74312 3.66473 4.93516 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 8.08382 6.1158 4.68668 7.74312 3.66473 4.93516 numMergedOcc 0
