0 mol 20 unq 0 iso 0 dist 9.33568 13.1492 8.67928 7.10314 9.74724 17.0937 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 9.33568 13.1492 8.67928 7.32361 9.13347 15.9137 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 9.23087 6.95532 9.59959 5.37935 8.32093 3.56619 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 9.23087 6.12187 9.33762 5.37935 8.32093 6.23171 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 4.32161 10.1563 7.77766 8.70456 5.16779 3.57191 numMergedOcc 0
5 mol 148 unq 0 iso 0 dist 8.78761 10.2345 8.03721 3.56704 8.88297 11.1423 numMergedOcc 0
6 mol 148 unq 1 iso 0 dist 8.78761 11.4224 9.87021 3.56704 8.88297 9.00149 numMergedOcc 0
7 mol 148 unq 2 iso 0 dist 8.78761 12.193 7.34023 3.56704 8.88297 10.5863 numMergedOcc 0
8 mol 148 unq 3 iso 0 dist 5.69707 7.11893 8.03721 8.33576 8.88297 11.1423 numMergedOcc 0
9 mol 148 unq 4 iso 0 dist 5.69707 12.5575 9.87021 8.33576 8.88297 9.00149 numMergedOcc 0
10 mol 148 unq 5 iso 0 dist 5.69707 11.2269 7.34023 8.33576 8.88297 10.5863 numMergedOcc 0
11 mol 150 unq 0 iso 0 dist 8.75537 10.3378 8.13558 3.56413 8.82984 11.289 numMergedOcc 0
12 mol 150 unq 1 iso 0 dist 8.75537 11.4403 9.96938 3.56413 8.82984 9.04793 numMergedOcc 0
13 mol 150 unq 2 iso 0 dist 8.75537 12.1772 7.35268 3.56413 8.82984 10.5688 numMergedOcc 0
14 mol 150 unq 3 iso 0 dist 5.62239 7.18025 8.13558 8.23832 8.82984 11.289 numMergedOcc 0
15 mol 150 unq 4 iso 0 dist 5.62239 12.5299 9.96938 8.23832 8.82984 9.04793 numMergedOcc 0
16 mol 150 unq 5 iso 0 dist 5.62239 11.1674 7.35268 8.23832 8.82984 10.5688 numMergedOcc 0
17 mol 197 unq 0 iso 0 dist 8.8252 7.07515 8.43104 17.4703 9.10527 16.1513 numMergedOcc 0
18 mol 197 unq 1 iso 0 dist 8.8252 13.1338 9.13452 17.4703 9.10527 11.1658 numMergedOcc 0
19 mol 210 unq 0 iso 0 dist 8.78286 9.83105 8.37183 5.30972 9.41473 5.63245 numMergedOcc 0
20 mol 210 unq 1 iso 0 dist 8.78286 13.302 6.6588 5.30972 9.41473 12.1701 numMergedOcc 0
21 mol 257 unq 0 iso 0 dist 9.75866 11.0762 8.48733 6.57478 8.86142 8.63927 numMergedOcc 0
22 mol 261 unq 0 iso 0 dist 9.17214 8.03534 9.57431 12.0622 9.39727 10.196 numMergedOcc 0
23 mol 261 unq 1 iso 0 dist 9.6169 10.2551 9.57431 7.32689 9.39727 10.196 numMergedOcc 0
24 mol 283 unq 0 iso 0 dist 5.7378 5.79481 7.36223 7.27864 9.74797 12.3984 numMergedOcc 0
25 mol 283 unq 1 iso 0 dist 5.7378 5.79481 7.36223 13.4741 9.90494 13.6429 numMergedOcc 0
26 mol 283 unq 2 iso 0 dist 7.15632 9.36073 7.36223 16.7441 9.74797 12.3984 numMergedOcc 0
27 mol 283 unq 3 iso 0 dist 7.15632 9.36073 7.36223 11.413 9.90494 13.6429 numMergedOcc 0
