0 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 13.2247 12.2333 9.36807 6.28925 10.6847 7.58143 8.70159 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.10621 9.36807 10.515 13.2247 10.5461 6.36911 8.70159 4.87279 7.58143 6.28925 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 8.4674 6.20943 5.14627 7.67038 4.54938 7.82528 14.6813 8.33878 13.3417 7.97324 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 7.82074 8.73972 6.55187 5.03957 4.54938 8.23643 10.9181 8.33878 7.24362 7.97324 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 4.51865 6.20943 4.69858 7.67038 6.864 7.82528 14.6813 11.8689 13.3417 7.97324 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 9.38498 8.70133 13.4082 5.4148 10.2049 4.65521 9.33919 15.9091 13.2106 9.79143 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 5.93252 5.64598 9.77992 7.4697 13.1662 8.70133 15.1135 21.0082 13.2106 9.33919 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 5.93252 5.64598 9.77992 5.7113 11.379 4.65521 15.1135 21.0082 13.2106 9.79143 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 9.96396 8.70133 7.41074 5.4148 6.19304 4.65521 9.33919 7.9151 13.2106 9.79143 numMergedOcc 0
9 mol 73 unq 4 iso 0 dist 6.19304 4.65521 7.41074 5.4148 9.96396 8.70133 9.79143 7.9151 13.2106 9.33919 numMergedOcc 0
10 mol 73 unq 5 iso 0 dist 9.75218 8.70133 15.9882 5.4148 11.6369 4.65521 9.33919 5.44172 13.2106 9.79143 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 7.97049 9.47876 7.98917 6.9948 7.47541 7.22293 9.30021 10.4545 4.59398 5.62635 numMergedOcc 0
12 mol 85 unq 1 iso 0 dist 7.97049 9.47876 7.98917 6.9948 7.47541 7.22293 13.5621 9.87083 10.755 7.07868 numMergedOcc 0
13 mol 85 unq 2 iso 0 dist 7.47541 7.22293 7.98917 6.9948 7.97049 9.47876 5.62635 10.4545 4.59398 9.30021 numMergedOcc 0
14 mol 85 unq 3 iso 0 dist 6.19965 9.47876 11.6116 6.9948 7.66905 7.22293 9.30021 12.3178 4.59398 5.62635 numMergedOcc 0
15 mol 85 unq 4 iso 0 dist 6.19965 9.47876 11.6116 6.9948 7.66905 7.22293 13.5621 11.3372 10.755 7.07868 numMergedOcc 0
16 mol 85 unq 5 iso 0 dist 7.66905 7.22293 11.6116 6.9948 6.19965 9.47876 5.62635 12.3178 4.59398 9.30021 numMergedOcc 0
17 mol 85 unq 6 iso 0 dist 5.73196 7.22293 6.47779 6.9948 11.2656 9.47876 5.62635 7.43006 4.59398 9.30021 numMergedOcc 0
18 mol 109 unq 0 iso 0 dist 8.69985 5.87358 9.46098 4.98336 13.4572 9.20981 13.2552 19.0391 18.2804 9.97334 numMergedOcc 0
19 mol 117 unq 0 iso 0 dist 7.83136 7.63616 4.91401 7.22206 7.90328 6.62561 11.3487 11.1062 6.37061 8.2236 numMergedOcc 0
20 mol 127 unq 0 iso 0 dist 8.14887 8.59981 14.9761 5.55757 12.8743 7.66331 5.72373 10.2773 4.98036 7.20988 numMergedOcc 0
21 mol 127 unq 1 iso 0 dist 8.14887 7.34519 7.41404 5.55757 12.8743 8.58999 5.72373 10.2773 8.57565 7.20988 numMergedOcc 0
22 mol 127 unq 2 iso 0 dist 9.30299 8.59981 14.085 5.55757 14.7391 7.66331 5.72373 10.7123 4.98036 7.20988 numMergedOcc 0
23 mol 127 unq 3 iso 0 dist 9.30299 7.34519 13.1312 5.55757 14.7391 8.58999 5.72373 10.7123 8.57565 7.20988 numMergedOcc 0
24 mol 234 unq 0 iso 0 dist 8.34494 6.25105 10.3337 5.88703 12.9605 7.85175 7.72403 10.3378 6.81789 6.35438 numMergedOcc 0
25 mol 234 unq 1 iso 0 dist 6.56247 6.25105 11.216 5.88703 9.45496 7.85175 7.72403 8.83842 6.81789 6.35438 numMergedOcc 0
26 mol 234 unq 2 iso 0 dist 9.36357 6.25105 11.4315 5.88703 6.7625 7.85175 7.72403 5.43327 6.81789 6.35438 numMergedOcc 0
27 mol 234 unq 3 iso 0 dist 9.45496 7.85175 11.216 5.88703 6.56247 6.25105 6.35438 8.83842 6.81789 7.72403 numMergedOcc 0
28 mol 234 unq 4 iso 0 dist 6.7625 7.85175 11.4315 5.88703 9.36357 6.25105 6.35438 5.43327 6.81789 7.72403 numMergedOcc 0
29 mol 235 unq 0 iso 0 dist 5.4638 9.58736 9.66021 16.4493 15.3051 6.98084 12.3464 10.4417 6.12136 7.48753 numMergedOcc 0
30 mol 259 unq 0 iso 0 dist 5.30224 8.37865 5.31048 12.5353 12.0576 7.48005 13.38 10.0556 5.15985 7.64122 numMergedOcc 0
