0 mol 10 unq 0 iso 0 dist 7.57901 10.5858 5.40169 7.97737 7.8329 5.75317 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 9.91882 8.12125 7.25707 7.24424 9.14809 10.0772 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.69823 10.1041 7.51285 6.59044 5.73454 5.15603 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 8.69823 10.1041 7.51285 4.63625 8.2012 8.37489 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 8.69823 10.1041 7.51285 11.1749 7.1829 12.6408 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 8.69823 3.92795 8.86698 6.59044 5.73454 8.08481 numMergedOcc 0
6 mol 48 unq 4 iso 0 dist 8.69823 3.92795 8.86698 4.63625 8.2012 5.87913 numMergedOcc 0
7 mol 48 unq 5 iso 0 dist 8.69823 3.92795 8.86698 11.1749 7.1829 9.01238 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 5.20528 11.5334 8.70863 6.53227 8.04853 14.1233 numMergedOcc 0
9 mol 85 unq 1 iso 0 dist 5.20528 11.5334 8.70863 3.93024 6.46549 14.3481 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 9.63085 11.016 5.39061 7.75948 7.84546 4.9293 numMergedOcc 0
11 mol 135 unq 0 iso 0 dist 5.95344 10.4311 9.40325 5.87899 8.72359 6.40035 numMergedOcc 0
12 mol 135 unq 1 iso 0 dist 5.95344 10.4311 9.40325 10.9982 7.02963 15.0661 numMergedOcc 0
13 mol 135 unq 2 iso 0 dist 5.95344 6.46708 8.25527 5.87899 8.72359 9.24509 numMergedOcc 0
14 mol 135 unq 3 iso 0 dist 5.95344 6.46708 8.25527 10.9982 7.02963 8.72293 numMergedOcc 0
15 mol 135 unq 4 iso 0 dist 5.95344 10.2113 8.83856 5.87899 8.72359 15.5423 numMergedOcc 0
16 mol 135 unq 5 iso 0 dist 5.95344 10.2113 8.83856 10.9982 7.02963 6.66299 numMergedOcc 0
17 mol 135 unq 6 iso 0 dist 7.8687 15.2788 9.40325 11.0453 8.72359 6.40035 numMergedOcc 0
18 mol 135 unq 7 iso 0 dist 7.8687 15.2788 9.40325 8.95563 7.02963 15.0661 numMergedOcc 0
19 mol 135 unq 8 iso 0 dist 7.8687 5.25373 8.25527 11.0453 8.72359 9.24509 numMergedOcc 0
20 mol 135 unq 9 iso 0 dist 7.8687 5.25373 8.25527 8.95563 7.02963 8.72293 numMergedOcc 0
21 mol 135 unq 10 iso 0 dist 7.8687 5.94856 8.83856 11.0453 8.72359 15.5423 numMergedOcc 0
22 mol 135 unq 11 iso 0 dist 7.8687 5.94856 8.83856 8.95563 7.02963 6.66299 numMergedOcc 0
23 mol 154 unq 0 iso 0 dist 8.85675 6.03671 6.51014 5.71332 8.90588 4.83835 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 8.41708 8.7763 7.46987 9.15827 8.72743 9.28201 numMergedOcc 0
25 mol 186 unq 1 iso 0 dist 6.0685 8.49599 7.02575 4.59453 8.2241 8.54557 numMergedOcc 0
26 mol 260 unq 0 iso 0 dist 4.76698 12.1177 7.99521 9.77348 6.49413 5.42399 numMergedOcc 0
27 mol 260 unq 1 iso 0 dist 4.76698 12.1177 7.99521 8.11438 6.12343 10.39 numMergedOcc 0
28 mol 260 unq 2 iso 0 dist 4.76698 12.1177 7.99521 3.43932 4.52405 9.79316 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 6.74022 12.9095 8.2997 3.47588 8.09181 13.6012 numMergedOcc 0
