0 mol 41 unq 0 iso 0 dist 6.59367 7.7727 7.42205 12.5752 6.73801 8.95105 numMergedOcc 0
1 mol 41 unq 1 iso 0 dist 6.59367 7.7727 7.42205 8.68242 6.42834 12.0668 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.80334 5.43913 5.67204 14.2257 7.34031 12.1255 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 8.80334 8.26877 4.28224 14.2257 7.34031 7.11491 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 8.45484 7.49794 4.12075 13.7393 7.281 7.1829 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 8.10708 8.185 7.57153 9.98108 9.43355 14.0138 numMergedOcc 0
6 mol 59 unq 1 iso 0 dist 8.10708 8.185 7.57153 12.8035 7.9327 12.6102 numMergedOcc 0
7 mol 59 unq 2 iso 0 dist 9.20253 6.68153 7.57153 15.8562 9.43355 14.0138 numMergedOcc 0
8 mol 59 unq 3 iso 0 dist 9.20253 6.68153 7.57153 10.3701 7.9327 12.6102 numMergedOcc 0
9 mol 61 unq 0 iso 0 dist 9.46217 7.93498 6.5311 9.89377 7.46994 11.954 numMergedOcc 0
10 mol 87 unq 0 iso 0 dist 7.2668 6.21471 3.63275 5.71028 9.28624 10.3339 numMergedOcc 0
11 mol 87 unq 1 iso 0 dist 7.2668 6.21471 3.63275 6.57984 8.31175 9.41934 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 8.22353 9.99012 4.19541 11.6598 9.30424 7.2932 numMergedOcc 0
13 mol 143 unq 1 iso 0 dist 8.57285 5.33772 4.19541 8.28318 9.30424 7.2932 numMergedOcc 0
14 mol 157 unq 0 iso 0 dist 5.87379 9.48169 6.02931 6.39342 6.455 8.76558 numMergedOcc 0
15 mol 167 unq 0 iso 0 dist 9.72291 8.43955 5.3461 7.33075 7.80054 10.1387 numMergedOcc 0
16 mol 175 unq 0 iso 0 dist 7.77669 8.06007 3.63393 10.3139 6.26365 4.51777 numMergedOcc 0
17 mol 175 unq 1 iso 0 dist 7.77669 8.06007 3.63393 7.04147 7.04177 4.9606 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 4.57548 7.24545 9.32521 5.86546 7.02079 10.0413 numMergedOcc 0
19 mol 239 unq 1 iso 0 dist 4.57548 7.24545 9.32521 8.35939 5.88802 14.2572 numMergedOcc 0
20 mol 273 unq 0 iso 0 dist 6.59786 8.13393 3.40141 7.10817 8.68913 11.6839 numMergedOcc 0
21 mol 273 unq 1 iso 0 dist 7.96519 8.13393 9.36978 4.30863 8.85779 11.9356 numMergedOcc 0
