0 mol 14 unq 0 iso 0 dist 8.32424 5.76472 7.59564 11.8308 6.24146 7.73217 numMergedOcc 0
1 mol 14 unq 1 iso 0 dist 8.32424 10.6449 8.10957 12.9952 4.81121 8.82819 numMergedOcc 0
2 mol 14 unq 2 iso 0 dist 8.32424 10.6449 8.10957 14.0753 7.95811 5.36937 numMergedOcc 0
3 mol 14 unq 3 iso 0 dist 8.32424 10.6449 8.10957 11.8308 6.24146 5.99703 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 8.10063 8.35576 5.85737 8.13365 6.88453 8.0319 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 5.5483 4.09692 7.32913 5.73331 6.9067 9.47348 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 9.30432 10.8436 7.32913 15.1227 6.9067 9.47348 numMergedOcc 0
7 mol 63 unq 0 iso 0 dist 7.10403 5.60513 6.49343 10.2467 7.01367 5.41831 numMergedOcc 0
8 mol 64 unq 0 iso 0 dist 6.27017 5.04832 8.85416 12.3941 10.9729 9.15386 numMergedOcc 0
9 mol 129 unq 0 iso 0 dist 7.28273 9.054 7.6453 10.3524 4.80675 8.00624 numMergedOcc 0
10 mol 129 unq 1 iso 0 dist 7.28273 9.054 7.6453 10.4368 7.01358 8.42289 numMergedOcc 0
11 mol 204 unq 0 iso 0 dist 7.30459 8.3119 6.20044 12.5413 6.12296 9.24822 numMergedOcc 0
12 mol 204 unq 1 iso 0 dist 8.73423 13.884 6.20044 13.2811 6.12296 9.24822 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 9.99396 5.39078 8.8113 8.47457 16.607 8.80858 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 8.27169 4.61365 6.9103 11.3476 10.2837 7.41931 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 8.88518 14.5913 8.10903 18.25 9.78068 9.04358 numMergedOcc 0
16 mol 280 unq 0 iso 0 dist 7.60676 7.87626 4.45141 12.5446 6.07005 5.41639 numMergedOcc 0
17 mol 280 unq 1 iso 0 dist 7.60676 7.87626 4.45141 12.4467 7.38048 7.96485 numMergedOcc 0
