0 mol 7 unq 0 iso 0 dist 9.20552 9.81211 5.51421 10.4548 5.99459 4.7739 12.839 5.13353 7.81271 10.1349 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.94828 4.93826 8.40051 4.54526 4.79873 6.29702 13.2682 10.9391 8.6396 12.3944 numMergedOcc 0
2 mol 25 unq 1 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
3 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
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 112 unq 0 iso 0 dist 7.42474 6.92638 7.53905 4.9759 9.05166 3.61827 12.6327 10.838 7.15985 10.2348 numMergedOcc 0
7 mol 112 unq 1 iso 0 dist 7.42474 6.92638 7.53905 6.59976 5.56994 3.78964 12.6327 10.838 7.15985 9.95699 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 9.00172 13.3005 5.82404 7.44092 8.77023 11.5628 8.66715 8.18495 9.50322 12.5855 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 8.84656 18.3189 9.60411 14.2595 9.33924 11.6349 10.9216 5.49782 9.92932 13.9752 numMergedOcc 0
10 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
11 mol 197 unq 0 iso 0 dist 6.18446 10.0696 8.3337 9.66766 9.10817 17.2264 11.5145 6.75702 5.41292 15.5058 numMergedOcc 0
12 mol 197 unq 1 iso 0 dist 6.18446 10.0696 8.3337 7.69814 9.73548 5.5875 11.5145 6.75702 5.41292 10.1477 numMergedOcc 0
13 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
14 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
15 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
16 mol 277 unq 0 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 1 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
18 mol 277 unq 2 iso 0 dist 8.53324 7.47195 8.96343 10.6814 5.13913 8.24206 7.151 7.69449 8.51931 11.4389 numMergedOcc 0
19 mol 277 unq 3 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
20 mol 277 unq 4 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
21 mol 277 unq 5 iso 0 dist 8.66941 5.65499 8.96343 8.42957 5.13913 8.24206 8.33977 7.69449 8.51931 11.4389 numMergedOcc 0
