0 mol 24 unq 0 iso 0 dist 7.40392 8.23069 5.54419 8.15652 4.33963 4.93188 10.2624 4.82629 6.6219 8.32592 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 7.40392 8.23069 5.54419 8.15652 4.33963 4.93188 13.5967 10.1698 5.68215 8.10397 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 7.40392 8.59466 7.36323 8.15652 4.33963 9.24958 13.1831 6.28159 8.87744 7.55689 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 7.40392 8.59466 7.36323 8.15652 4.33963 9.24958 11.0243 5.50396 7.27472 5.11135 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 6.84521 5.84171 5.73819 11.2885 5.64171 8.60739 10.8355 4.96926 6.75943 4.55347 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 8.06275 5.5249 8.80331 13.1618 9.06158 9.93832 8.74209 5.41726 6.6263 4.55347 numMergedOcc 0
6 mol 43 unq 2 iso 0 dist 8.06275 10.4413 6.20293 13.1618 9.06158 8.60739 8.74209 5.41726 6.75943 4.55347 numMergedOcc 0
7 mol 43 unq 3 iso 0 dist 8.90024 13.9129 8.80331 11.2885 9.06158 9.93832 10.8355 5.41726 6.6263 4.55347 numMergedOcc 0
8 mol 43 unq 4 iso 0 dist 8.90024 5.84171 6.20293 11.2885 9.06158 8.60739 10.8355 5.41726 6.75943 4.55347 numMergedOcc 0
9 mol 43 unq 5 iso 0 dist 6.78532 5.84171 8.93915 11.2885 11.3891 8.60739 10.8355 10.0383 6.75943 4.55347 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 9.9795 13.0232 6.19965 17.7383 7.91778 7.33422 13.066 4.41789 7.7068 6.33204 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 5.79157 13.0109 9.86662 5.8367 5.12325 8.20836 8.8437 4.00092 7.21868 4.935 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 7.73769 7.36837 5.99315 15.2492 12.7056 8.41611 11.8017 13.1926 7.36975 9.05786 numMergedOcc 0
13 mol 143 unq 1 iso 0 dist 7.73769 7.36837 5.99315 15.2492 12.7056 8.41611 12.3347 7.39837 5.40637 6.16103 numMergedOcc 0
14 mol 143 unq 2 iso 0 dist 7.73769 7.36837 5.99315 13.5961 12.8872 7.63338 11.8017 13.1926 7.36975 3.75378 numMergedOcc 0
15 mol 143 unq 3 iso 0 dist 7.73769 7.36837 5.99315 13.5961 12.8872 7.63338 12.3347 7.39837 5.40637 8.4697 numMergedOcc 0
16 mol 143 unq 4 iso 0 dist 7.73769 7.36837 5.99315 14.5866 7.76364 9.03707 11.8017 13.1926 7.36975 14.0356 numMergedOcc 0
17 mol 143 unq 5 iso 0 dist 7.73769 7.36837 5.99315 14.5866 7.76364 9.03707 12.3347 7.39837 5.40637 5.41614 numMergedOcc 0
18 mol 143 unq 6 iso 0 dist 7.73769 7.36837 5.99315 12.8216 9.23795 7.25673 11.8017 13.1926 7.36975 9.30534 numMergedOcc 0
19 mol 143 unq 7 iso 0 dist 7.73769 7.36837 5.99315 12.8216 9.23795 7.25673 12.3347 7.39837 5.40637 6.78032 numMergedOcc 0
20 mol 152 unq 0 iso 0 dist 8.34839 5.65129 8.56324 13.8395 9.35627 9.77552 9.4275 5.39112 6.59889 4.71678 numMergedOcc 0
21 mol 152 unq 1 iso 0 dist 8.34839 5.65129 8.56324 13.8395 9.35627 9.77552 9.83462 4.84714 8.9192 7.11377 numMergedOcc 0
22 mol 152 unq 2 iso 0 dist 8.34839 10.5295 6.70283 13.8395 9.35627 8.28642 9.4275 5.39112 6.70693 4.71678 numMergedOcc 0
23 mol 222 unq 0 iso 0 dist 7.88846 6.17038 7.54212 11.1196 7.60395 8.48341 11.0981 12.8595 6.74196 9.0716 numMergedOcc 0
24 mol 222 unq 1 iso 0 dist 7.88846 6.17038 7.54212 11.1196 7.60395 8.48341 14.5172 12.5866 8.36842 10.5383 numMergedOcc 0
25 mol 222 unq 2 iso 0 dist 7.88846 6.17038 7.54212 11.1196 7.60395 8.48341 15.5123 11.9567 9.75472 8.90753 numMergedOcc 0
26 mol 229 unq 0 iso 0 dist 6.32302 6.52416 8.22528 14.0993 11.6847 8.92743 9.90415 5.70473 7.27993 6.93188 numMergedOcc 0
27 mol 229 unq 1 iso 0 dist 6.88694 6.52416 7.03423 14.0993 9.62106 8.92743 9.90415 7.22525 7.27993 6.93188 numMergedOcc 0
28 mol 229 unq 2 iso 0 dist 8.53615 6.81165 8.22528 10.3106 11.6847 8.92743 5.96615 5.70473 7.27993 6.93188 numMergedOcc 0
29 mol 236 unq 0 iso 0 dist 8.95071 12.8358 6.27581 9.33359 7.00028 8.50331 14.8517 10.5774 9.3206 5.59363 numMergedOcc 0
30 mol 248 unq 0 iso 0 dist 7.40475 7.63032 7.69895 9.08064 5.99459 6.17052 11.6204 4.58289 9.05018 7.14182 numMergedOcc 0
