0 mol 7 unq 0 iso 0 dist 9.20552 9.81211 5.51421 10.4548 5.99459 4.7739 11.1443 12.2041 13.5184 9.67164 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.94828 4.93826 8.40051 16.0229 9.48085 13.591 13.2682 10.9391 8.6396 9.49421 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 9.81637 9.37897 6.36193 6.69301 9.22598 4.99692 12.4928 4.81926 4.88613 8.96727 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 8.27156 8.33049 8.1599 7.751 6.9103 5.46563 12.0244 8.62608 14.3699 9.69044 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 8.27307 5.10938 5.47319 5.29207 5.99857 4.69809 6.92837 8.99811 9.8809 6.9362 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 6.92837 5.10938 9.8809 5.29207 6.9362 4.69809 8.27307 8.99811 5.47319 5.99857 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 8.84656 18.3189 9.60411 15.9796 7.93372 3.76211 14.0056 10.7144 13.0095 9.66543 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 8.84656 18.3189 9.60411 15.9796 7.93372 3.76211 10.9216 5.49782 9.92932 7.21868 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 6.09874 14.0799 9.58911 5.43915 8.59874 17.3349 9.75336 6.01247 9.86845 9.76212 numMergedOcc 0
9 mol 197 unq 0 iso 0 dist 6.18446 10.0696 8.3337 9.66766 9.10817 17.2264 9.96544 5.43601 13.2564 6.86828 numMergedOcc 0
10 mol 218 unq 0 iso 0 dist 9.79816 16.0359 7.73315 15.4347 7.33709 3.5359 12.5084 4.72474 7.0843 8.75536 numMergedOcc 0
11 mol 218 unq 1 iso 0 dist 9.79816 16.0359 7.73315 15.4347 7.33709 3.5359 15.3307 5.61978 6.9398 6.67404 numMergedOcc 0
12 mol 264 unq 0 iso 0 dist 8.85887 10.1159 6.83408 12.6528 9.58916 3.63202 13.3833 8.96144 7.36905 5.90924 numMergedOcc 0
13 mol 264 unq 1 iso 0 dist 8.85887 10.1159 6.83408 12.6528 9.58916 3.63202 17.9702 14.3597 9.43335 5.90058 numMergedOcc 0
14 mol 277 unq 0 iso 0 dist 7.151 12.4082 9.77689 10.3171 9.57499 17.8399 8.53324 7.69449 17.2403 5.46926 numMergedOcc 0
15 mol 277 unq 1 iso 0 dist 7.151 12.4082 9.77689 10.3171 9.57499 17.8399 7.23956 11.8268 19.3912 8.9682 numMergedOcc 0
16 mol 277 unq 2 iso 0 dist 7.151 7.47195 8.51931 10.3171 9.57499 6.17642 8.53324 7.69449 8.96343 5.46926 numMergedOcc 0
17 mol 277 unq 3 iso 0 dist 7.151 7.47195 8.51931 10.3171 9.57499 6.17642 7.23956 11.8268 9.71491 8.9682 numMergedOcc 0
18 mol 277 unq 4 iso 0 dist 8.53324 7.47195 8.96343 10.3171 5.46926 6.17642 7.151 7.69449 8.51931 9.57499 numMergedOcc 0
19 mol 277 unq 5 iso 0 dist 8.53324 7.47195 8.96343 10.3171 5.46926 6.17642 7.23956 7.08227 9.71491 8.9682 numMergedOcc 0
20 mol 277 unq 6 iso 0 dist 8.53324 7.47195 8.96343 10.6814 5.13913 8.24206 7.23956 7.08227 9.71491 6.92711 numMergedOcc 0
21 mol 277 unq 7 iso 0 dist 7.23956 12.7088 9.29635 10.3171 8.9682 12.2421 7.151 11.8268 17.8158 9.57499 numMergedOcc 0
22 mol 277 unq 8 iso 0 dist 7.23956 12.7088 9.29635 10.3171 8.9682 12.2421 8.53324 7.08227 14.3464 5.46926 numMergedOcc 0
23 mol 277 unq 9 iso 0 dist 7.23956 12.7088 9.29635 10.6814 6.92711 10.9521 8.53324 7.08227 14.3464 5.13913 numMergedOcc 0
24 mol 277 unq 10 iso 0 dist 8.33977 14.7999 9.77689 5.04761 9.57499 17.8399 8.66941 7.69449 17.2403 5.46926 numMergedOcc 0
25 mol 277 unq 11 iso 0 dist 8.33977 14.7999 9.77689 5.04761 9.57499 17.8399 12.8481 11.8268 19.3912 8.9682 numMergedOcc 0
26 mol 277 unq 12 iso 0 dist 8.33977 5.65499 8.51931 5.04761 9.57499 6.17642 8.66941 7.69449 8.96343 5.46926 numMergedOcc 0
27 mol 277 unq 13 iso 0 dist 8.33977 5.65499 8.51931 5.04761 9.57499 6.17642 12.8481 11.8268 9.71491 8.9682 numMergedOcc 0
28 mol 277 unq 14 iso 0 dist 8.66941 5.65499 8.96343 5.04761 5.46926 6.17642 8.33977 7.69449 8.51931 9.57499 numMergedOcc 0
29 mol 277 unq 15 iso 0 dist 8.66941 5.65499 8.96343 5.04761 5.46926 6.17642 12.8481 7.08227 9.71491 8.9682 numMergedOcc 0
30 mol 277 unq 16 iso 0 dist 8.66941 5.65499 8.96343 8.42957 5.13913 8.24206 12.8481 7.08227 9.71491 6.92711 numMergedOcc 0
