0 mol 15 unq 0 iso 0 dist 8.0637 4.89563 5.69927 7.38118 5.70754 8.4014 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 6.49446 8.30291 11.1759 10.9175 8.7531 17.1835 numMergedOcc 0
2 mol 62 unq 1 iso 0 dist 6.49446 8.30291 11.1759 5.4275 7.25138 9.81276 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 8.23695 8.74231 13.2118 13.2176 9.00612 12.9747 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 5.8409 8.40871 7.17843 7.4829 8.48827 7.91148 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 5.8409 8.40871 7.17843 8.47947 7.14048 6.59794 numMergedOcc 0
6 mol 78 unq 2 iso 0 dist 8.13368 8.40871 4.4651 7.4829 8.03895 7.91148 numMergedOcc 0
7 mol 78 unq 3 iso 0 dist 8.13368 8.40871 4.4651 8.47947 5.68873 6.59794 numMergedOcc 0
8 mol 103 unq 0 iso 0 dist 8.8763 8.26309 9.45824 7.6171 5.53454 11.5381 numMergedOcc 0
9 mol 120 unq 0 iso 0 dist 9.35529 9.41521 5.89379 5.37018 9.58434 10.2878 numMergedOcc 0
10 mol 120 unq 1 iso 0 dist 9.35529 9.41521 5.89379 5.79975 9.16089 6.42623 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 4.76012 6.1421 6.43966 8.90391 7.04904 13.0143 numMergedOcc 0
12 mol 129 unq 1 iso 0 dist 4.76012 6.1421 6.43966 5.85476 5.06053 10.4172 numMergedOcc 0
13 mol 147 unq 0 iso 0 dist 8.94007 9.11046 6.91778 5.76262 8.76449 6.73617 numMergedOcc 0
14 mol 147 unq 1 iso 0 dist 8.94007 9.11046 6.91778 4.09924 8.36182 9.03544 numMergedOcc 0
15 mol 168 unq 0 iso 0 dist 8.80094 7.53748 13.1236 3.6038 8.47543 10.3143 numMergedOcc 0
16 mol 171 unq 0 iso 0 dist 8.30819 8.68992 10.5731 10.7165 7.06555 14.1482 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 9.37765 6.20985 4.94882 3.98361 9.14525 5.90765 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 6.17749 8.81925 4.82768 4.73685 4.90656 5.1609 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 8.15743 6.94983 9.60401 9.67326 9.67243 12.5802 numMergedOcc 0
20 mol 243 unq 0 iso 0 dist 9.6748 8.19458 16.7618 6.56644 6.46793 14.4361 numMergedOcc 0
21 mol 243 unq 1 iso 0 dist 9.6748 9.45133 16.2753 6.56644 6.46793 14.2282 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 9.44043 8.14812 9.07364 6.55101 6.61322 8.03012 numMergedOcc 0
23 mol 270 unq 0 iso 0 dist 4.60602 9.02113 5.00269 9.89802 7.97614 8.65354 numMergedOcc 0
