0 mol 26 unq 0 iso 0 dist 9.08976 17.0306 9.25649 9.99989 5.88467 8.85591 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.08976 11.9941 9.36104 9.99989 5.88467 9.67576 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.76059 9.81068 9.36424 18.0741 11.6013 9.69215 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 8.8197 11.2894 9.36424 17.5126 11.6013 9.69215 numMergedOcc 0
4 mol 41 unq 0 iso 0 dist 7.41523 8.02771 5.52067 11.0361 5.14132 8.19484 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 5.77804 3.74136 7.85041 8.84466 12.5605 8.42713 numMergedOcc 0
6 mol 93 unq 1 iso 0 dist 5.77804 3.74136 7.85041 9.2948 10.878 8.21032 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 5.89919 7.33078 9.89462 12.8817 10.7037 9.85832 numMergedOcc 0
8 mol 128 unq 1 iso 0 dist 5.89919 7.33078 9.89462 10.885 8.80709 7.49024 numMergedOcc 0
9 mol 128 unq 2 iso 0 dist 8.04178 5.34549 9.89462 8.54297 10.7037 9.85832 numMergedOcc 0
10 mol 128 unq 3 iso 0 dist 8.04178 5.34549 9.89462 9.35162 8.80709 7.49024 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 9.02079 4.91324 5.38314 8.87505 4.72188 6.62468 numMergedOcc 0
12 mol 140 unq 0 iso 0 dist 9.53229 7.91707 8.06396 13.7207 6.63467 8.73523 numMergedOcc 0
13 mol 140 unq 1 iso 0 dist 9.53229 10.9413 8.01587 13.7207 6.63467 7.85653 numMergedOcc 0
14 mol 146 unq 0 iso 0 dist 9.39237 10.1462 8.68349 14.3066 9.77501 5.04351 numMergedOcc 0
15 mol 147 unq 0 iso 0 dist 7.9061 5.78019 5.1101 5.70772 4.10092 6.4752 numMergedOcc 0
16 mol 147 unq 1 iso 0 dist 4.48898 5.78019 7.01133 5.70772 4.47436 6.4752 numMergedOcc 0
17 mol 147 unq 2 iso 0 dist 6.36426 4.52246 5.1101 5.03663 4.10092 6.4752 numMergedOcc 0
18 mol 147 unq 3 iso 0 dist 7.06711 4.52246 7.01133 5.03663 4.47436 6.4752 numMergedOcc 0
19 mol 147 unq 4 iso 0 dist 7.6489 5.88056 5.1101 8.93916 4.10092 6.4752 numMergedOcc 0
20 mol 158 unq 0 iso 0 dist 7.63085 4.19444 6.39981 10.169 5.49464 6.92225 numMergedOcc 0
21 mol 175 unq 0 iso 0 dist 7.06919 11.1891 7.01126 13.8673 10.3187 9.12296 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 8.22583 5.80934 5.49808 8.94464 6.24616 9.91705 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 8.22583 5.80934 5.49808 12.7823 5.56759 7.92476 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 6.62037 5.27973 5.49808 11.8438 6.24616 9.91705 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 6.62037 5.27973 5.49808 8.92685 5.56759 7.92476 numMergedOcc 0
26 mol 181 unq 4 iso 0 dist 6.21461 5.27973 7.96291 11.8438 12.5567 9.91705 numMergedOcc 0
27 mol 181 unq 5 iso 0 dist 6.21461 5.27973 7.96291 8.92685 4.43465 7.92476 numMergedOcc 0
28 mol 239 unq 0 iso 0 dist 9.2456 5.79235 7.94894 12.0903 4.9045 8.81373 numMergedOcc 0
29 mol 240 unq 0 iso 0 dist 8.3417 5.02268 5.66537 12.064 3.97303 8.44671 numMergedOcc 0
