0 mol 58 unq 0 iso 0 dist 6.40841 8.69057 11.0945 8.34191 3.8375 11.7295 10.8779 16.0571 8.66539 17.9574 numMergedOcc 0
1 mol 58 unq 1 iso 0 dist 6.40841 8.69057 11.0945 8.34191 3.8375 11.7295 5.47421 10.335 5.38524 12.1872 numMergedOcc 0
2 mol 58 unq 2 iso 0 dist 6.40841 8.69057 11.0945 6.39747 6.11446 5.77163 10.8779 16.0571 8.66539 12.8726 numMergedOcc 0
3 mol 58 unq 3 iso 0 dist 6.40841 8.69057 11.0945 6.39747 6.11446 5.77163 5.47421 10.335 5.38524 7.4785 numMergedOcc 0
4 mol 58 unq 4 iso 0 dist 8.89374 8.96727 14.6599 7.17488 4.43437 10.5853 4.81926 11.5023 9.22598 9.9105 numMergedOcc 0
5 mol 72 unq 0 iso 0 dist 9.02278 6.21799 5.5067 6.62699 7.82564 4.38233 7.04035 14.5113 9.74228 8.26541 numMergedOcc 0
6 mol 72 unq 1 iso 0 dist 9.02278 6.21799 5.5067 6.62699 7.82564 4.38233 8.24309 12.0903 7.12321 4.86198 numMergedOcc 0
7 mol 72 unq 2 iso 0 dist 9.02278 5.03251 4.01021 6.62699 7.82564 5.62585 5.8486 13.0378 9.56773 8.98867 numMergedOcc 0
8 mol 72 unq 3 iso 0 dist 8.624 9.74228 9.88768 8.26541 10.4337 4.38233 5.36766 6.77912 7.12321 4.86198 numMergedOcc 0
9 mol 72 unq 4 iso 0 dist 8.624 9.74228 9.88768 8.26541 10.4337 4.38233 7.04035 11.9814 6.21799 6.62699 numMergedOcc 0
10 mol 72 unq 5 iso 0 dist 6.77912 7.12321 9.88768 4.86198 10.4337 4.38233 5.36766 8.624 9.74228 8.26541 numMergedOcc 0
11 mol 72 unq 6 iso 0 dist 6.77912 7.12321 9.88768 4.86198 10.4337 4.38233 8.24309 11.9814 6.21799 6.62699 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 7.13087 5.61588 8.97361 8.62079 15.7104 10.0644 8.07446 13.6145 5.5087 7.37171 numMergedOcc 0
13 mol 73 unq 1 iso 0 dist 7.13087 7.83244 10.2983 8.62079 15.7104 12.1501 8.07446 13.6145 6.08682 7.37171 numMergedOcc 0
14 mol 88 unq 0 iso 0 dist 8.66514 7.80898 7.15936 9.07128 3.99025 9.11654 12.1547 14.3557 7.51139 16.5543 numMergedOcc 0
15 mol 88 unq 1 iso 0 dist 8.66514 7.80898 7.15936 6.65615 6.69123 10.8983 12.1547 14.3557 7.51139 16.665 numMergedOcc 0
16 mol 88 unq 2 iso 0 dist 9.25235 7.80898 10.8763 9.07128 6.08504 9.11654 12.1547 17.4216 7.51139 16.5543 numMergedOcc 0
17 mol 88 unq 3 iso 0 dist 9.25235 7.80898 10.8763 6.65615 3.77436 10.8983 12.1547 17.4216 7.51139 16.665 numMergedOcc 0
18 mol 127 unq 0 iso 0 dist 6.63981 7.79505 6.15949 6.80627 5.87751 11.1934 6.55997 10.5605 7.36199 13.1048 numMergedOcc 0
19 mol 132 unq 0 iso 0 dist 6.03703 6.89918 6.545 5.77186 5.82383 6.96373 4.35917 7.61505 7.89457 9.72307 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 7.98142 9.01624 12.2513 8.29467 9.55459 11.4645 11.5866 16.7285 5.05973 14.7884 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 7.37327 9.01624 14.8923 8.29467 7.66761 11.4645 11.5866 18.3916 5.05973 14.7884 numMergedOcc 0
22 mol 218 unq 0 iso 0 dist 8.53199 7.33709 11.6662 7.84952 6.19774 13.5381 4.72474 12.0819 8.75536 11.8692 numMergedOcc 0
23 mol 218 unq 1 iso 0 dist 8.53199 7.33709 11.6662 7.84952 6.19774 13.5381 5.61978 13.6555 6.67404 12.5146 numMergedOcc 0
24 mol 219 unq 0 iso 0 dist 4.87541 4.33238 3.78261 9.64116 5.88671 8.59843 7.02195 10.105 7.83604 15.8203 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 9.41725 8.9682 18.3854 4.9764 13.6468 5.9732 11.8268 19.0768 9.57499 12.762 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 9.41725 8.9682 18.3854 4.9764 13.6468 5.9732 7.08227 15.6511 5.46926 7.42932 numMergedOcc 0
27 mol 277 unq 2 iso 0 dist 9.41725 8.9682 18.3854 6.36559 13.3297 8.61922 11.8268 19.0768 9.57499 14.7874 numMergedOcc 0
28 mol 277 unq 3 iso 0 dist 9.41725 8.9682 18.3854 6.36559 13.3297 8.61922 7.08227 15.6511 5.46926 10.5562 numMergedOcc 0
29 mol 277 unq 4 iso 0 dist 9.41725 6.92711 16.1088 4.9764 13.6468 3.79766 7.08227 15.6511 5.13913 7.42932 numMergedOcc 0
30 mol 277 unq 5 iso 0 dist 9.41725 6.92711 16.1088 6.36559 13.3297 7.07613 7.08227 15.6511 5.13913 10.5562 numMergedOcc 0
