0 mol 26 unq 0 iso 0 dist 9.32113 7.23962 8.42581 11.5211 5.81836 13.1887 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 8.58057 9.45587 5.86571 9.59328 9.53772 7.35201 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 8.58057 9.45587 5.86571 6.17483 7.3576 4.30611 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 7.65992 12.7743 8.80104 9.16047 5.44028 6.29218 numMergedOcc 0
4 mol 74 unq 0 iso 0 dist 9.9321 5.67386 4.79413 13.7278 8.12551 9.7556 numMergedOcc 0
5 mol 111 unq 0 iso 0 dist 8.52122 8.37101 7.92876 11.508 6.63857 4.81641 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 9.2746 11.3281 9.87025 10.9551 8.81779 4.15435 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 9.2746 6.21945 5.85818 10.9551 8.81779 9.54775 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 9.14135 15.3515 8.12589 9.46631 6.49708 12.0468 numMergedOcc 0
9 mol 150 unq 0 iso 0 dist 9.12067 15.4401 8.11592 9.47461 6.45018 12.1191 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 8.15524 10.1854 6.39981 8.44698 9.38045 6.39711 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 9.8747 7.13867 9.83885 9.78143 9.85415 4.13682 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 9.8747 7.13867 9.83885 6.68457 5.96238 10.0576 numMergedOcc 0
13 mol 205 unq 2 iso 0 dist 9.8747 7.13867 9.83885 11.3047 8.24405 15.5169 numMergedOcc 0
14 mol 205 unq 3 iso 0 dist 8.01082 7.13867 5.42696 9.78143 6.61806 4.13682 numMergedOcc 0
15 mol 205 unq 4 iso 0 dist 8.01082 7.13867 5.42696 6.68457 7.85966 10.0576 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 8.45863 5.23668 7.2498 12.523 9.734 7.71824 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 5.81013 6.50862 7.95883 7.99404 7.87985 5.317 numMergedOcc 0
18 mol 230 unq 0 iso 0 dist 9.03723 8.36854 8.85215 7.37963 7.74885 10.0105 numMergedOcc 0
19 mol 252 unq 0 iso 0 dist 9.00798 6.15482 6.57207 5.52764 6.5058 4.17197 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 9.84755 9.58208 9.51311 13.5046 9.96989 18.5505 numMergedOcc 0
21 mol 258 unq 1 iso 0 dist 9.84755 9.58208 9.51311 6.08193 4.57246 7.61474 numMergedOcc 0
22 mol 261 unq 0 iso 0 dist 9.39571 13.3708 9.24121 8.52438 7.75255 14.3809 numMergedOcc 0
23 mol 261 unq 1 iso 0 dist 9.39571 13.3708 9.24121 13.4103 8.96013 15.1504 numMergedOcc 0
24 mol 272 unq 0 iso 0 dist 7.36125 6.5996 6.45328 13.8298 9.75798 9.96708 numMergedOcc 0
25 mol 272 unq 1 iso 0 dist 7.47128 8.2571 6.98048 12.3888 9.28899 4.86323 numMergedOcc 0
