0 mol 16 unq 0 iso 0 dist 5.84479 8.67719 5.32694 5.35079 6.31718 10.9143 6.04677 8.43054 11.1513 4.65873 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 5.84479 8.67719 5.32694 6.53177 7.63133 5.46498 6.04677 8.43054 11.1513 9.81307 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 7.84983 9.56737 4.81926 11.5882 6.62496 6.35756 5.04521 9.22598 8.96727 9.87158 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 9.56737 7.84983 4.81926 11.5882 6.35756 6.62496 5.04521 8.96727 9.22598 9.87158 numMergedOcc 0
4 mol 58 unq 2 iso 0 dist 9.56737 7.84983 4.81926 11.5882 6.35756 6.62496 10.2341 8.01308 9.55996 5.86526 numMergedOcc 0
5 mol 60 unq 0 iso 0 dist 8.82095 6.27749 6.54743 5.63638 6.65595 8.90863 7.32774 7.57295 7.48086 7.80499 numMergedOcc 0
6 mol 60 unq 1 iso 0 dist 8.82095 6.27749 6.54743 5.95814 9.25011 10.0828 7.32774 7.57295 7.48086 5.6397 numMergedOcc 0
7 mol 60 unq 2 iso 0 dist 8.82095 6.27749 6.54743 13.6099 6.43294 11.5843 7.32774 7.57295 7.48086 8.62476 numMergedOcc 0
8 mol 60 unq 3 iso 0 dist 8.82095 6.27749 6.54743 12.0142 8.52121 12.4757 7.32774 7.57295 7.48086 6.55502 numMergedOcc 0
9 mol 60 unq 4 iso 0 dist 6.27749 8.82095 6.54743 5.63638 8.90863 6.65595 4.44758 9.95132 12.544 8.27828 numMergedOcc 0
10 mol 60 unq 5 iso 0 dist 6.27749 8.82095 6.54743 5.63638 8.90863 6.65595 7.32774 7.48086 7.57295 7.80499 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 9.514 7.84888 5.02055 11.8037 7.4729 11.862 12.7532 8.3773 12.4353 4.46885 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 8.21889 9.74643 7 5.5332 7.34473 8.58044 10.4255 6.29161 11.0751 6.73011 numMergedOcc 0
13 mol 109 unq 1 iso 0 dist 8.21889 9.74643 7 5.5332 7.34473 8.58044 14.5244 7.86666 14.3511 13.0886 numMergedOcc 0
14 mol 109 unq 2 iso 0 dist 8.21889 6.86702 8.40993 5.5332 7.34473 9.97763 10.4255 6.29161 13.6787 6.73011 numMergedOcc 0
15 mol 109 unq 3 iso 0 dist 8.21889 6.86702 8.40993 5.5332 7.34473 9.97763 14.5244 7.86666 15.7916 13.0886 numMergedOcc 0
16 mol 142 unq 0 iso 0 dist 7.57458 8.48413 7.81981 13.1936 9.2313 14.7391 9.23267 7.81207 13.0632 4.67662 numMergedOcc 0
17 mol 142 unq 1 iso 0 dist 7.57458 8.48413 7.81981 13.1936 9.2313 14.7391 13.4776 7.18002 12.8971 13.5913 numMergedOcc 0
18 mol 142 unq 2 iso 0 dist 7.57458 8.48413 7.81981 12.288 7.73169 15.1873 9.23267 7.81207 13.0632 5.81599 numMergedOcc 0
19 mol 142 unq 3 iso 0 dist 7.57458 8.48413 7.81981 12.288 7.73169 15.1873 13.4776 7.18002 12.8971 9.99555 numMergedOcc 0
20 mol 142 unq 4 iso 0 dist 7.57458 8.48413 7.81981 14.2067 8.96657 16.6217 9.23267 7.81207 13.0632 11.1 numMergedOcc 0
21 mol 142 unq 5 iso 0 dist 7.57458 8.48413 7.81981 14.2067 8.96657 16.6217 13.4776 7.18002 12.8971 6.52253 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 9.79616 9.34636 4.70378 5.63485 6.57273 8.95269 12.65 8.79428 13.2325 7.05804 numMergedOcc 0
23 mol 224 unq 1 iso 0 dist 9.79616 9.34636 4.70378 9.36962 6.60589 9.99123 12.65 8.79428 13.2325 5.76843 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 5.24313 6.83152 5.42006 12.1448 7.31233 10.0756 12.4194 9.12776 13.9551 10.3162 numMergedOcc 0
25 mol 259 unq 0 iso 0 dist 6.77279 9.58006 4.69778 7.55268 8.53687 10.5767 9.90573 9.07743 7.66153 6.73882 numMergedOcc 0
26 mol 259 unq 1 iso 0 dist 6.77279 9.58006 4.69778 5.71237 8.13497 7.88519 9.90573 9.07743 7.66153 8.8603 numMergedOcc 0
27 mol 259 unq 2 iso 0 dist 9.58006 6.77279 4.69778 5.71237 7.88519 8.13497 12.7528 9.63573 12.8229 7.20604 numMergedOcc 0
28 mol 259 unq 3 iso 0 dist 9.58006 6.77279 4.69778 5.71237 7.88519 8.13497 9.90573 7.66153 9.07743 8.8603 numMergedOcc 0
29 mol 259 unq 4 iso 0 dist 9.58006 6.77279 4.69778 9.10984 7.84554 9.95973 12.7528 9.63573 12.8229 5.05362 numMergedOcc 0
30 mol 259 unq 5 iso 0 dist 9.58006 6.77279 4.69778 9.10984 7.84554 9.95973 9.90573 7.66153 9.07743 5.8801 numMergedOcc 0
31 mol 259 unq 6 iso 0 dist 9.58006 6.77279 4.69778 11.8501 7.46176 10.3935 12.7528 9.63573 12.8229 5.21606 numMergedOcc 0
32 mol 259 unq 7 iso 0 dist 9.58006 6.77279 4.69778 11.8501 7.46176 10.3935 9.90573 7.66153 9.07743 11.8896 numMergedOcc 0
33 mol 259 unq 8 iso 0 dist 9.58006 6.77279 4.69778 13.9868 9.18903 12.6839 12.7528 9.63573 12.8229 7.46841 numMergedOcc 0
34 mol 259 unq 9 iso 0 dist 9.58006 6.77279 4.69778 13.9868 9.18903 12.6839 9.90573 7.66153 9.07743 5.81576 numMergedOcc 0
35 mol 276 unq 0 iso 0 dist 9.05218 7.70061 8.56707 5.72513 9.8993 10.033 5.58312 8.6759 11.298 9.39944 numMergedOcc 0
36 mol 276 unq 1 iso 0 dist 9.05218 7.70061 8.56707 8.86096 6.87396 12.6292 5.58312 8.6759 11.298 8.26321 numMergedOcc 0
37 mol 277 unq 0 iso 0 dist 6.90434 8.57532 12.7728 13.2927 9.7748 19.7909 8.51268 9.35539 17.0567 11.4555 numMergedOcc 0
38 mol 277 unq 1 iso 0 dist 6.90434 8.57532 12.7728 13.2927 9.7748 19.7909 13.3706 8.9682 14.9195 17.6038 numMergedOcc 0
39 mol 277 unq 2 iso 0 dist 6.90434 8.57532 12.7728 13.2927 9.7748 19.7909 12.1739 6.92711 14.2174 14.772 numMergedOcc 0
40 mol 277 unq 3 iso 0 dist 6.90434 9.02914 7.08227 13.2927 9.7748 16.3537 8.51268 9.35539 14.9313 11.4555 numMergedOcc 0
41 mol 277 unq 4 iso 0 dist 6.90434 9.02914 7.08227 13.2927 9.7748 16.3537 13.3706 8.9682 5.46926 17.6038 numMergedOcc 0
42 mol 277 unq 5 iso 0 dist 6.90434 9.02914 7.08227 13.2927 9.7748 16.3537 12.1739 6.92711 5.13913 14.772 numMergedOcc 0
