0 mol 0 unq 0 iso 0 dist 9.94618 6.94181 14.0556 5.98788 7.06591 12.6486 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.10175 6.54183 10.1356 9.57335 11.14 4.15717 numMergedOcc 0
2 mol 54 unq 1 iso 0 dist 6.10175 6.54183 10.1356 8.60653 7.93241 5.99981 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 8.47302 8.2147 5.4217 9.3727 7.88316 10.1786 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 8.87856 5.85841 6.83826 6.04768 11.3708 11.3905 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 8.87856 7.00285 9.94628 6.04768 11.3708 4.67519 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 6.2491 5.85841 9.30656 6.04768 7.43547 11.3905 numMergedOcc 0
7 mol 98 unq 3 iso 0 dist 6.2491 7.00285 5.39087 6.04768 7.43547 4.67519 numMergedOcc 0
8 mol 98 unq 4 iso 0 dist 3.59451 6.78839 9.30656 9.40173 7.43547 11.3905 numMergedOcc 0
9 mol 98 unq 5 iso 0 dist 3.59451 8.02354 5.39087 9.40173 7.43547 4.67519 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 7.26463 8.88255 9.35307 8.61574 13.6411 9.89358 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 9.07096 7.85527 11.2951 8.05937 6.4025 7.45148 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 4.95086 6.87299 5.90364 9.69865 7.84711 6.97477 numMergedOcc 0
13 mol 156 unq 0 iso 0 dist 9.04176 9.68507 4.08699 6.40435 5.0315 6.03934 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 8.03259 8.90247 6.94401 9.99409 9.21613 8.91338 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 8.03259 6.58792 5.07895 9.99409 9.21613 11.85 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 8.58709 6.21273 4.90657 7.58118 4.39102 7.11498 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 7.99145 7.71761 11.4528 6.65275 5.75236 6.48027 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 4.21935 6.83046 5.29737 9.25097 5.51771 9.59042 numMergedOcc 0
19 mol 239 unq 1 iso 0 dist 9.78444 8.7017 7.87566 6.47859 10.225 5.05321 numMergedOcc 0
20 mol 256 unq 0 iso 0 dist 8.11884 5.98967 9.07441 9.31961 6.82173 7.7384 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 8.83777 7.07459 12.7283 7.88238 12.5151 9.87336 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 9.42812 7.07459 13.8339 7.88238 5.10104 9.87336 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 8.36655 8.68797 5.34376 5.21664 13.4771 12.6502 numMergedOcc 0
24 mol 279 unq 1 iso 0 dist 8.76889 5.70546 9.36068 8.6522 12.7014 12.6264 numMergedOcc 0
25 mol 279 unq 2 iso 0 dist 6.37469 5.70546 5.13535 8.6522 9.63044 12.6264 numMergedOcc 0
26 mol 280 unq 0 iso 0 dist 9.047 8.80588 14.1091 9.55885 4.6462 14.1713 numMergedOcc 0
27 mol 280 unq 1 iso 0 dist 9.9227 8.80588 4.95798 9.55885 12.0238 14.1713 numMergedOcc 0
