0 mol 7 unq 0 iso 0 dist 5.80034 8.88982 4.57188 14.8431 9.85726 11.0773 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.83056 8.88982 6.09254 13.9585 7.21217 7.10621 numMergedOcc 0
2 mol 13 unq 0 iso 0 dist 6.6621 9.92193 9.7299 13.4043 7.97656 17.2754 numMergedOcc 0
3 mol 110 unq 0 iso 0 dist 7.67702 7.2461 12.3557 9.86374 7.21229 15.8747 numMergedOcc 0
4 mol 110 unq 1 iso 0 dist 7.67702 7.2461 12.3557 5.33778 5.25492 11.4939 numMergedOcc 0
5 mol 110 unq 2 iso 0 dist 7.67702 9.26333 11.0242 9.86374 7.21229 15.6852 numMergedOcc 0
6 mol 110 unq 3 iso 0 dist 7.67702 9.26333 11.0242 5.33778 5.25492 11.8454 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 5.38954 9.60425 6.29427 5.17524 7.70533 9.84395 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 9.78409 8.09965 9.75166 11.3174 8.40046 9.30299 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 9.02183 8.80581 5.16386 10.3296 6.43406 9.11469 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 7.9678 6.04106 6.4623 9.7129 8.43584 10.9575 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 8.14413 7.86668 5.82028 5.06314 9.67457 6.18308 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 9.47309 8.47457 13.2364 10.5254 6.56437 9.99123 numMergedOcc 0
13 mol 234 unq 0 iso 0 dist 9.5831 4.91961 6.16697 11.5103 5.89084 9.45496 numMergedOcc 0
14 mol 234 unq 1 iso 0 dist 9.5831 4.91961 6.16697 4.98993 8.47009 6.7625 numMergedOcc 0
15 mol 234 unq 2 iso 0 dist 9.5831 7.14333 16.1011 11.5103 5.89084 17.458 numMergedOcc 0
16 mol 234 unq 3 iso 0 dist 9.5831 7.14333 16.1011 4.98993 8.47009 10.701 numMergedOcc 0
17 mol 236 unq 0 iso 0 dist 6.02845 5.99137 9.92965 5.6375 9.31246 10.9008 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 6.86905 6.51823 7.22173 5.88384 5.56719 10.3007 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 5.62744 6.92721 5.29737 9.00069 6.37342 6.16342 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 8.8726 5.31858 9.22664 6.60345 8.58088 6.42289 numMergedOcc 0
21 mol 258 unq 1 iso 0 dist 8.8726 5.71851 13.0489 6.60345 8.58088 10.1675 numMergedOcc 0
22 mol 265 unq 0 iso 0 dist 5.14122 8.59825 7.8929 11.5005 9.59213 17.3458 numMergedOcc 0
23 mol 265 unq 1 iso 0 dist 5.14122 7.83102 5.56416 11.5005 9.59213 12.0259 numMergedOcc 0
24 mol 282 unq 0 iso 0 dist 5.72197 7.34596 4.58403 4.36798 5.67266 8.76532 numMergedOcc 0
25 mol 282 unq 1 iso 0 dist 5.72197 7.12228 5.04235 4.36798 5.67266 6.33524 numMergedOcc 0
