0 mol 5 unq 0 iso 0 dist 9.41648 8.07747 7.46092 8.87863 11.6969 5.30596 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 6.47185 6.81211 6.92267 9.72136 13.7886 8.01746 numMergedOcc 0
2 mol 46 unq 1 iso 0 dist 6.47185 6.81211 6.92267 4.61355 8.70524 6.97552 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 6.69386 5.86234 6.52334 5.92285 6.44497 5.45648 numMergedOcc 0
4 mol 62 unq 1 iso 0 dist 6.69386 5.86234 6.52334 8.38687 13.6782 10.0519 numMergedOcc 0
5 mol 62 unq 2 iso 0 dist 9.09269 5.86234 11.6069 5.92285 8.03921 5.45648 numMergedOcc 0
6 mol 62 unq 3 iso 0 dist 9.09269 5.86234 11.6069 8.38687 3.83635 10.0519 numMergedOcc 0
7 mol 83 unq 0 iso 0 dist 9.54935 6.98288 7.00472 6.61587 5.03778 6.98792 numMergedOcc 0
8 mol 83 unq 1 iso 0 dist 9.54935 6.98288 7.00472 8.24464 8.54787 5.38871 numMergedOcc 0
9 mol 89 unq 0 iso 0 dist 9.48877 7.45116 5.70859 6.00509 4.72096 6.24175 numMergedOcc 0
10 mol 125 unq 0 iso 0 dist 9.06392 9.99265 16.4454 9.69767 16.0066 6.4982 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 7.19559 6.10045 10.7998 6.81609 9.19479 6.12306 numMergedOcc 0
12 mol 130 unq 1 iso 0 dist 7.19559 6.10045 10.7998 7.86701 8.73882 4.91853 numMergedOcc 0
13 mol 130 unq 2 iso 0 dist 7.19559 6.10045 10.7998 9.77422 12.2802 4.78135 numMergedOcc 0
14 mol 178 unq 0 iso 0 dist 5.79795 6.07118 5.39133 8.74572 3.93042 6.0136 numMergedOcc 0
15 mol 178 unq 1 iso 0 dist 5.79795 6.07118 5.39133 8.62441 3.95924 5.93246 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 9.24248 5.06235 13.3388 6.112 9.15328 6.13691 numMergedOcc 0
17 mol 255 unq 0 iso 0 dist 5.83014 7.82773 9.87744 8.08403 4.04928 8.852 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 7.02347 7.89685 11.6429 9.45605 6.32315 9.7286 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 8.10763 8.67773 7.70951 6.01636 3.98157 4.30667 numMergedOcc 0
20 mol 292 unq 1 iso 0 dist 7.78353 8.67773 11.3853 6.01636 10.7442 4.30667 numMergedOcc 0
