0 mol 10 unq 0 iso 0 dist 8.03458 9.03951 11.04 4.37568 9.97671 12.3901 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.2106 9.03951 9.13852 7.54307 9.9373 15.6703 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 8.2106 9.03951 9.13852 4.37568 7.83087 12.3901 numMergedOcc 0
3 mol 17 unq 0 iso 0 dist 7.34681 9.78918 16.9932 4.2802 6.64199 12.7769 numMergedOcc 0
4 mol 17 unq 1 iso 0 dist 7.34681 6.80314 13.5569 4.2802 6.64199 8.26398 numMergedOcc 0
5 mol 30 unq 0 iso 0 dist 8.204 8.90581 8.50024 4.83638 9.11745 12.7096 numMergedOcc 0
6 mol 30 unq 1 iso 0 dist 8.204 8.90581 8.50024 5.2103 4.62145 9.94082 numMergedOcc 0
7 mol 30 unq 2 iso 0 dist 8.204 8.90581 8.50024 14.1481 9.71995 16.9836 numMergedOcc 0
8 mol 48 unq 0 iso 0 dist 9.53081 6.42242 5.84184 15.1442 7.90416 13.1918 numMergedOcc 0
9 mol 48 unq 1 iso 0 dist 9.53081 6.42242 5.84184 4.89976 9.74553 5.72703 numMergedOcc 0
10 mol 67 unq 0 iso 0 dist 5.80736 9.42982 7.47077 8.43533 9.10001 10.4773 numMergedOcc 0
11 mol 67 unq 1 iso 0 dist 5.80736 8.17929 5.92208 8.43533 9.10001 13.7596 numMergedOcc 0
12 mol 67 unq 2 iso 0 dist 5.80736 5.63802 4.53519 8.43533 9.10001 10.0501 numMergedOcc 0
13 mol 87 unq 0 iso 0 dist 7.57471 8.59105 4.99645 6.90315 9.20673 9.41934 numMergedOcc 0
14 mol 92 unq 0 iso 0 dist 7.70612 6.6186 5.04277 4.65353 9.62106 9.22418 numMergedOcc 0
15 mol 101 unq 0 iso 0 dist 7.1859 7.73086 4.93063 4.4529 7.33426 9.44645 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 8.6953 6.86997 4.74651 3.54257 9.0735 8.74878 numMergedOcc 0
17 mol 148 unq 1 iso 0 dist 8.6953 7.46919 9.03832 3.54257 9.0735 10.0716 numMergedOcc 0
18 mol 148 unq 2 iso 0 dist 8.6953 8.24581 10.0113 3.54257 9.0735 11.5421 numMergedOcc 0
19 mol 150 unq 0 iso 0 dist 8.65967 6.79381 4.75241 3.59609 9.03593 8.74018 numMergedOcc 0
20 mol 150 unq 1 iso 0 dist 8.65967 7.36989 9.0892 3.59609 9.03593 10.0288 numMergedOcc 0
21 mol 150 unq 2 iso 0 dist 8.65967 8.17805 10.21 3.59609 9.03593 11.5569 numMergedOcc 0
22 mol 188 unq 0 iso 0 dist 8.1907 6.47305 10.2716 8.6599 7.50005 13.4764 numMergedOcc 0
23 mol 188 unq 1 iso 0 dist 8.1907 6.20426 5.01686 8.6599 7.50005 8.4784 numMergedOcc 0
24 mol 204 unq 0 iso 0 dist 9.52029 9.46973 4.29037 16.0878 8.98633 13.0868 numMergedOcc 0
25 mol 205 unq 0 iso 0 dist 5.86839 6.23057 4.79372 4.51847 4.93303 6.81516 numMergedOcc 0
26 mol 205 unq 1 iso 0 dist 5.86839 6.23057 4.79372 10.9814 9.95859 12.4828 numMergedOcc 0
27 mol 230 unq 0 iso 0 dist 9.14989 9.07808 4.32112 9.09648 7.51295 8.91416 numMergedOcc 0
28 mol 230 unq 1 iso 0 dist 9.24729 8.85051 9.16476 4.45276 9.62914 12.4872 numMergedOcc 0
29 mol 230 unq 2 iso 0 dist 9.24729 8.85051 9.16476 15.7177 9.73038 17.8376 numMergedOcc 0
30 mol 244 unq 0 iso 0 dist 7.79787 9.97458 4.89551 4.80974 9.45199 9.30179 numMergedOcc 0
31 mol 244 unq 1 iso 0 dist 7.79787 9.97458 4.89551 13.59 9.07512 6.10489 numMergedOcc 0
32 mol 256 unq 0 iso 0 dist 6.45473 9.65136 9.83915 6.51471 9.49634 4.36333 numMergedOcc 0
33 mol 261 unq 0 iso 0 dist 4.85199 6.45102 5.52134 4.30068 7.14871 9.41212 numMergedOcc 0
34 mol 261 unq 1 iso 0 dist 9.13604 9.20425 5.52134 10.2597 7.14871 9.41212 numMergedOcc 0
35 mol 271 unq 0 iso 0 dist 9.50884 7.03848 11.0964 12.9579 9.97897 17.8218 numMergedOcc 0
36 mol 282 unq 0 iso 0 dist 6.04225 8.42086 4.0078 4.01024 7.21879 8.46115 numMergedOcc 0
37 mol 282 unq 1 iso 0 dist 5.00258 7.84236 4.0078 4.4471 7.21879 8.46115 numMergedOcc 0
38 mol 282 unq 2 iso 0 dist 9.98886 7.84236 12.9261 12.5442 9.60384 16.8564 numMergedOcc 0
