0 mol 20 unq 0 iso 0 dist 6.86736 9.0017 5.51967 9.47299 11.9168 8.72342 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 8.17383 9.0017 9.92805 9.47299 11.6967 8.72342 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 5.78969 7.90364 6.17529 5.68596 8.29857 6.28603 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 5.7898 7.78518 6.30002 5.69576 8.19993 5.73454 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.32568 6.89022 10.1455 8.89627 9.17082 8.75957 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 6.34085 5.83263 4.32751 10.029 11.4928 8.21895 numMergedOcc 0
6 mol 62 unq 1 iso 0 dist 6.48274 5.83263 4.83294 10.029 12.9142 8.21895 numMergedOcc 0
7 mol 113 unq 0 iso 0 dist 5.9758 8.46167 13.5955 8.69658 10.4727 7.40338 numMergedOcc 0
8 mol 113 unq 1 iso 0 dist 5.9758 8.46167 13.5955 11.1416 14.1273 6.23759 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 9.66687 9.8911 4.60864 5.06665 5.87084 7.84546 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 9.68242 7.02043 4.60864 7.7998 5.87084 7.84546 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 7.90709 8.56285 3.80087 8.90481 9.83945 9.59109 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 9.03842 8.56285 3.80763 8.90481 6.75376 9.59109 numMergedOcc 0
13 mol 182 unq 0 iso 0 dist 9.48378 8.58391 3.73864 3.6277 11.1375 9.02127 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 9.02161 8.93083 4.12242 5.9935 7.54099 7.02762 numMergedOcc 0
15 mol 184 unq 1 iso 0 dist 8.38137 5.62851 4.12242 8.11291 7.54099 7.02762 numMergedOcc 0
16 mol 197 unq 0 iso 0 dist 8.43104 9.10527 16.1513 5.47413 12.4118 9.15715 numMergedOcc 0
17 mol 197 unq 1 iso 0 dist 9.13452 9.10527 11.1658 5.47413 13.1911 9.15715 numMergedOcc 0
18 mol 230 unq 0 iso 0 dist 8.19003 9.28671 8.76971 13.7681 12.1459 8.91416 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 5.96512 8.27566 5.18533 11.0519 12.4284 9.36974 numMergedOcc 0
