0 mol 6 unq 0 iso 0 dist 8.4681 6.46784 9.11785 10.1929 9.1305 13.4723 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 7.55743 9.09015 7.54307 5.24846 9.1125 9.6309 numMergedOcc 0
2 mol 10 unq 1 iso 0 dist 7.55743 7.70383 4.37568 5.24846 9.1125 9.23414 numMergedOcc 0
3 mol 17 unq 0 iso 0 dist 7.30541 7.18716 9.78953 4.20667 9.65377 11.2032 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 7.10403 9.56838 4.44607 4.40557 9.1662 10.0461 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 8.10965 9.75833 5.28796 8.1253 7.52954 11.8074 numMergedOcc 0
6 mol 116 unq 0 iso 0 dist 8.49761 6.98134 11.193 10.0549 7.67429 14.6922 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 9.26609 5.94465 6.41211 8.64874 9.83596 6.01857 numMergedOcc 0
8 mol 151 unq 0 iso 0 dist 8.15628 5.91643 4.5975 4.20596 5.62891 6.12972 numMergedOcc 0
9 mol 204 unq 0 iso 0 dist 8.73423 9.38235 13.1706 4.92057 8.40718 8.29256 numMergedOcc 0
10 mol 204 unq 1 iso 0 dist 8.73423 8.95509 5.79978 4.92057 8.40718 7.8274 numMergedOcc 0
11 mol 233 unq 0 iso 0 dist 6.50096 6.45095 5.02086 3.63541 8.20598 7.40498 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 8.88518 4.98907 13.3447 3.89286 9.17911 6.61322 numMergedOcc 0
13 mol 258 unq 1 iso 0 dist 8.88518 4.98907 13.3447 16.57 9.52903 20.9486 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 9.4961 9.2684 15.5294 7.46031 9.36806 16.7099 numMergedOcc 0
15 mol 266 unq 1 iso 0 dist 9.4961 9.2684 15.5294 12.0129 7.51446 20.4771 numMergedOcc 0
16 mol 294 unq 0 iso 0 dist 9.23009 8.65363 8.9978 9.32276 5.71656 9.42655 numMergedOcc 0
17 mol 294 unq 1 iso 0 dist 9.23009 6.44588 5.13965 9.32276 5.71656 7.48987 numMergedOcc 0
