0 mol 69 unq 0 iso 0 dist 7.67696 8.88983 5.45501 4.06151 8.29328 11.4228 numMergedOcc 0
1 mol 117 unq 0 iso 0 dist 9.26609 5.38954 5.13142 8.64874 9.83596 6.81489 numMergedOcc 0
2 mol 123 unq 0 iso 0 dist 7.99359 6.36344 9.13867 4.99882 8.56386 7.97266 numMergedOcc 0
3 mol 123 unq 1 iso 0 dist 9.14514 6.36344 7.70166 4.99882 7.15869 7.97266 numMergedOcc 0
4 mol 123 unq 2 iso 0 dist 6.17633 8.71375 7.70166 4.3524 7.15869 7.97266 numMergedOcc 0
5 mol 131 unq 0 iso 0 dist 8.89564 9.58388 7.49696 4.26345 9.09918 11.8448 numMergedOcc 0
6 mol 131 unq 1 iso 0 dist 8.89564 6.77889 4.1643 4.26345 9.09918 8.89412 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.13344 9.18505 5.16554 6.45157 4.69402 8.63817 numMergedOcc 0
8 mol 151 unq 0 iso 0 dist 8.15628 8.96469 7.72755 4.20596 5.62891 9.74969 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 8.72113 9.26913 4.96821 7.45659 5.83898 9.01869 numMergedOcc 0
10 mol 223 unq 0 iso 0 dist 4.30445 6.33896 5.30247 6.11508 7.29418 10.8327 numMergedOcc 0
11 mol 223 unq 1 iso 0 dist 4.30445 6.33896 5.30247 8.58714 8.63099 13.335 numMergedOcc 0
12 mol 233 unq 0 iso 0 dist 6.50096 9.99681 8.37757 3.63541 8.20598 11.8093 numMergedOcc 0
13 mol 233 unq 1 iso 0 dist 9.91416 9.89626 8.37757 6.30963 8.20598 11.8093 numMergedOcc 0
14 mol 253 unq 0 iso 0 dist 8.2681 8.08789 9.02376 4.69007 8.32005 10.3193 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 8.88518 7.42888 9.0655 3.89286 9.17911 10.3095 numMergedOcc 0
16 mol 258 unq 1 iso 0 dist 8.88518 7.42888 9.0655 16.57 9.52903 13.9865 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 9.4961 6.55208 15.1918 7.46031 9.36806 11.3 numMergedOcc 0
18 mol 266 unq 1 iso 0 dist 9.4961 6.55208 15.1918 12.0129 7.51446 17.0772 numMergedOcc 0
19 mol 266 unq 2 iso 0 dist 8.3978 7.17562 15.1918 7.87257 9.36806 11.3 numMergedOcc 0
20 mol 266 unq 3 iso 0 dist 8.3978 7.17562 15.1918 11.6181 7.51446 17.0772 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 9.04355 7.78656 4.38561 12.8871 6.76192 10.8411 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 9.04355 7.78656 4.38561 12.8871 6.76192 10.8411 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 9.04355 7.78656 4.38561 12.8871 6.76192 10.8411 numMergedOcc 0
24 mol 294 unq 0 iso 0 dist 9.23009 6.6112 6.79888 9.32276 5.71656 10.7501 numMergedOcc 0
25 mol 294 unq 1 iso 0 dist 9.23009 8.34193 12.8482 9.32276 5.71656 15.4564 numMergedOcc 0
26 mol 294 unq 2 iso 0 dist 9.23009 8.35722 7.05161 9.32276 5.71656 5.27236 numMergedOcc 0
