0 mol 8 unq 0 iso 0 dist 9.68072 8.76702 9.62683 4.11115 6.68091 8.89145 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.68072 6.27477 7.08043 4.11115 6.68091 6.92865 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 7.63261 7.23594 6.47139 11.1282 7.9504 13.5046 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 6.38662 9.15042 5.16403 6.12165 5.44077 9.05728 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 8.99557 9.31319 15.919 15.9669 9.31292 24.0882 numMergedOcc 0
5 mol 46 unq 1 iso 0 dist 8.99557 8.2513 17.0196 15.9669 9.31292 24.0727 numMergedOcc 0
6 mol 53 unq 0 iso 0 dist 6.47588 8.61163 7.21475 6.31644 6.64564 12.8059 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 8.54807 6.05043 5.33325 7.79077 9.02302 10.2352 numMergedOcc 0
8 mol 99 unq 0 iso 0 dist 4.06171 8.5073 5.81348 4.73115 8.44207 11.1598 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 8.40514 8.03567 5.97308 8.76824 5.31333 10.0005 numMergedOcc 0
10 mol 204 unq 0 iso 0 dist 6.99474 7.92766 10.6493 3.96829 4.45738 7.7292 numMergedOcc 0
11 mol 204 unq 1 iso 0 dist 6.99474 6.32652 4.30341 3.96829 4.45738 6.27396 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 6.99667 8.3035 4.55245 9.75439 7.1951 10.8385 numMergedOcc 0
13 mol 214 unq 1 iso 0 dist 6.22499 9.01896 4.55245 10.9516 7.1951 10.8385 numMergedOcc 0
14 mol 217 unq 0 iso 0 dist 6.00351 8.28941 6.20364 6.94126 8.72578 5.10683 numMergedOcc 0
15 mol 217 unq 1 iso 0 dist 6.00351 8.28941 6.20364 8.73011 8.80103 14.3153 numMergedOcc 0
16 mol 227 unq 0 iso 0 dist 7.49227 9.93154 8.65229 14.4022 9.87685 17.7749 numMergedOcc 0
17 mol 227 unq 1 iso 0 dist 7.49227 9.18218 13.0161 14.4022 9.87685 21.3213 numMergedOcc 0
18 mol 227 unq 2 iso 0 dist 7.49227 6.18486 11.8065 14.4022 9.87685 18.862 numMergedOcc 0
19 mol 272 unq 0 iso 0 dist 5.19015 7.22438 8.31324 13.9278 9.52059 17.3151 numMergedOcc 0
20 mol 272 unq 1 iso 0 dist 5.19015 7.66615 9.38679 13.9278 9.52059 17.1553 numMergedOcc 0
21 mol 276 unq 0 iso 0 dist 9.63988 7.11272 14.3233 7.74891 9.5388 14.6555 numMergedOcc 0
22 mol 276 unq 1 iso 0 dist 9.63988 6.24808 10.8564 7.74891 9.5388 8.95876 numMergedOcc 0
23 mol 284 unq 0 iso 0 dist 9.00473 9.27402 4.45344 15.519 8.77418 7.35866 numMergedOcc 0
24 mol 284 unq 1 iso 0 dist 9.00473 9.26573 5.88217 15.519 8.77418 7.32482 numMergedOcc 0
