0 mol 24 unq 0 iso 0 dist 8.14598 9.20254 7.95042 14.3935 7.7447 15.4638 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 4.74069 7.46414 7.26639 5.09927 7.00717 10.028 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 8.79235 10.7201 7.28228 14.8207 9.32314 4.32161 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 6.44825 11 8.3733 8.43533 5.88409 4.04753 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 9.90923 14.8791 9.8703 8.41751 8.19932 10.9724 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 9.90923 5.31976 7.39665 8.41751 8.19932 10.6721 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 6.14248 5.82267 8.23026 5.50078 5.45099 4.27653 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 6.14248 5.82267 8.23026 11.6055 8.44765 10.934 numMergedOcc 0
8 mol 76 unq 2 iso 0 dist 6.14248 5.82267 8.23026 13.5729 9.06643 11.8887 numMergedOcc 0
9 mol 76 unq 3 iso 0 dist 6.97936 12.6179 8.23026 11.6853 5.45099 4.27653 numMergedOcc 0
10 mol 76 unq 4 iso 0 dist 6.97936 12.6179 8.23026 15.0489 8.44765 10.934 numMergedOcc 0
11 mol 76 unq 5 iso 0 dist 6.97936 12.6179 8.23026 14.2393 9.06643 11.8887 numMergedOcc 0
12 mol 76 unq 6 iso 0 dist 5.00466 7.88072 8.23026 4.94673 5.45099 4.27653 numMergedOcc 0
13 mol 76 unq 7 iso 0 dist 5.00466 7.88072 8.23026 5.78236 8.44765 10.934 numMergedOcc 0
14 mol 76 unq 8 iso 0 dist 5.00466 7.88072 8.23026 4.73151 9.06643 11.8887 numMergedOcc 0
15 mol 95 unq 0 iso 0 dist 8.23073 7.95165 8.27883 6.84485 4.3439 4.73066 numMergedOcc 0
16 mol 95 unq 1 iso 0 dist 8.23073 6.67589 7.7152 6.84485 4.3439 4.20834 numMergedOcc 0
17 mol 95 unq 2 iso 0 dist 5.99965 6.36989 9.11586 6.85215 8.72957 6.28746 numMergedOcc 0
18 mol 98 unq 0 iso 0 dist 6.84952 5.82029 7.02507 4.52783 7.14813 9.71703 numMergedOcc 0
19 mol 116 unq 0 iso 0 dist 8.33185 6.57937 8.28795 11.193 9.87354 5.49724 numMergedOcc 0
20 mol 139 unq 0 iso 0 dist 6.79625 8.16051 5.80789 5.4082 8.83962 6.10392 numMergedOcc 0
21 mol 139 unq 1 iso 0 dist 7.20542 4.78289 5.80789 7.77973 8.83962 6.10392 numMergedOcc 0
22 mol 152 unq 0 iso 0 dist 9.17216 6.62991 6.59889 16.3297 8.60651 10.6994 numMergedOcc 0
23 mol 152 unq 1 iso 0 dist 9.17216 13.4463 6.70693 16.3297 8.60651 4.68615 numMergedOcc 0
24 mol 152 unq 2 iso 0 dist 9.40483 7.17016 6.59889 11.5151 8.60651 10.6994 numMergedOcc 0
25 mol 152 unq 3 iso 0 dist 9.40483 11.3742 6.70693 11.5151 8.60651 4.68615 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 6.49577 8.24478 8.73533 5.86994 8.17928 12.1883 numMergedOcc 0
27 mol 186 unq 1 iso 0 dist 9.76574 10.0248 8.73533 16.9837 8.17928 12.1883 numMergedOcc 0
28 mol 205 unq 0 iso 0 dist 6.75579 4.25942 6.52816 3.50159 4.97301 6.49049 numMergedOcc 0
29 mol 205 unq 1 iso 0 dist 9.867 6.45734 7.21137 15.4168 7.68686 9.8496 numMergedOcc 0
30 mol 205 unq 2 iso 0 dist 9.867 15.4114 8.4844 15.4168 7.68686 4.69695 numMergedOcc 0
31 mol 225 unq 0 iso 0 dist 8.94981 17.0867 8.1945 10.8002 8.74463 14.2198 numMergedOcc 0
32 mol 225 unq 1 iso 0 dist 8.94981 6.89798 6.50998 10.8002 8.74463 9.72811 numMergedOcc 0
33 mol 255 unq 0 iso 0 dist 7.58813 9.02294 6.87333 13.7865 8.7958 6.08042 numMergedOcc 0
34 mol 255 unq 1 iso 0 dist 7.58813 4.15604 9.86207 13.7865 8.7958 13.4617 numMergedOcc 0
35 mol 272 unq 0 iso 0 dist 5.38409 4.78295 6.44147 4.58591 5.53492 5.00122 numMergedOcc 0
36 mol 272 unq 1 iso 0 dist 8.45524 8.26567 6.44147 8.33955 5.53492 5.00122 numMergedOcc 0
37 mol 285 unq 0 iso 0 dist 6.24134 9.237 7.80862 4.57431 7.73438 8.33646 numMergedOcc 0
