0 mol 26 unq 0 iso 0 dist 8.8533 7.54726 6.73259 14.1116 7.61055 10.1809 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.8533 15.6533 8.60352 14.1116 7.61055 4.53839 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 6.87744 12.5131 6.73259 6.23975 7.61055 10.1809 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 6.87744 7.40006 8.60352 6.23975 7.61055 4.53839 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 8.8717 6.87212 9.69215 10.8155 9.36424 11.6013 numMergedOcc 0
5 mol 34 unq 1 iso 0 dist 8.72742 6.66112 7.27883 15.3125 6.93364 12.2054 numMergedOcc 0
6 mol 34 unq 2 iso 0 dist 8.72742 6.66112 7.27883 12.762 6.34821 9.09489 numMergedOcc 0
7 mol 52 unq 0 iso 0 dist 9.87921 6.12403 9.46302 12.8073 8.65019 8.88127 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 5.94459 6.51886 5.74389 9.67231 8.80104 10.492 numMergedOcc 0
9 mol 74 unq 0 iso 0 dist 6.2442 5.11539 9.43699 5.2745 4.79413 10.1834 numMergedOcc 0
10 mol 74 unq 1 iso 0 dist 6.2442 5.6967 5.23115 5.2745 4.79413 3.94075 numMergedOcc 0
11 mol 111 unq 0 iso 0 dist 6.90574 4.51896 9.82548 13.9086 7.92876 15.3233 numMergedOcc 0
12 mol 128 unq 0 iso 0 dist 8.83011 10.0023 9.85832 5.21787 9.89462 10.7037 numMergedOcc 0
13 mol 128 unq 1 iso 0 dist 8.83011 4.9915 7.49024 5.21787 9.89462 8.80709 numMergedOcc 0
14 mol 146 unq 0 iso 0 dist 4.83039 6.08259 5.04351 5.57852 8.1069 6.04249 numMergedOcc 0
15 mol 146 unq 1 iso 0 dist 4.83039 6.08259 5.04351 11.4615 8.68349 9.77501 numMergedOcc 0
16 mol 146 unq 2 iso 0 dist 5.38829 4.67177 5.04351 4.75435 8.1069 6.04249 numMergedOcc 0
17 mol 146 unq 3 iso 0 dist 5.38829 4.67177 5.04351 6.21982 8.68349 9.77501 numMergedOcc 0
18 mol 146 unq 4 iso 0 dist 7.498 6.31044 5.04351 10.1016 8.1069 6.04249 numMergedOcc 0
19 mol 146 unq 5 iso 0 dist 7.498 6.31044 5.04351 5.91626 8.68349 9.77501 numMergedOcc 0
20 mol 154 unq 0 iso 0 dist 6.03116 9.95968 9.2042 10.4329 7.53158 12.9483 numMergedOcc 0
21 mol 154 unq 1 iso 0 dist 6.03116 9.95968 9.2042 7.55279 7.43407 9.90775 numMergedOcc 0
22 mol 163 unq 0 iso 0 dist 8.74174 9.10578 9.3832 14.2403 8.21476 14.7696 numMergedOcc 0
23 mol 163 unq 1 iso 0 dist 8.74174 9.10578 9.3832 9.45801 7.66897 9.55472 numMergedOcc 0
24 mol 163 unq 2 iso 0 dist 8.74174 9.44058 6.0247 14.2403 8.21476 6.00005 numMergedOcc 0
25 mol 163 unq 3 iso 0 dist 8.74174 9.44058 6.0247 9.45801 7.66897 6.69711 numMergedOcc 0
26 mol 163 unq 4 iso 0 dist 8.74174 5.51241 6.40873 14.2403 8.21476 9.09427 numMergedOcc 0
27 mol 163 unq 5 iso 0 dist 8.74174 5.51241 6.40873 9.45801 7.66897 5.45003 numMergedOcc 0
28 mol 239 unq 0 iso 0 dist 8.74485 6.94884 8.81373 6.95257 7.18771 6.0331 numMergedOcc 0
29 mol 239 unq 1 iso 0 dist 8.74485 6.94884 8.81373 9.98418 7.94894 4.9045 numMergedOcc 0
30 mol 240 unq 0 iso 0 dist 5.46783 8.79048 8.44671 12.0688 8.33853 7.4874 numMergedOcc 0
31 mol 240 unq 1 iso 0 dist 5.46783 8.79048 8.44671 5.53988 5.66537 3.97303 numMergedOcc 0
32 mol 250 unq 0 iso 0 dist 9.26007 10.3683 9.43554 5.99898 8.70484 14.0983 numMergedOcc 0
33 mol 250 unq 1 iso 0 dist 9.26007 12.9156 9.21681 5.99898 8.70484 10.9117 numMergedOcc 0
34 mol 252 unq 0 iso 0 dist 8.62351 14.0369 9.81593 7.02444 5.2361 7.31906 numMergedOcc 0
35 mol 252 unq 1 iso 0 dist 8.62351 14.0369 9.81593 13.7396 5.57515 12.2338 numMergedOcc 0
36 mol 252 unq 2 iso 0 dist 8.62351 14.0369 9.81593 14.6186 8.28694 14.2535 numMergedOcc 0
37 mol 252 unq 3 iso 0 dist 8.62351 13.2459 9.78248 7.02444 5.2361 12.8039 numMergedOcc 0
38 mol 252 unq 4 iso 0 dist 8.62351 13.2459 9.78248 13.7396 5.57515 8.32839 numMergedOcc 0
39 mol 252 unq 5 iso 0 dist 8.62351 13.2459 9.78248 14.6186 8.28694 5.63228 numMergedOcc 0
40 mol 252 unq 6 iso 0 dist 9.44744 7.47327 5.22349 8.26489 6.57207 7.31906 numMergedOcc 0
41 mol 252 unq 7 iso 0 dist 6.94319 7.47327 9.81593 8.26489 5.2361 7.31906 numMergedOcc 0
42 mol 252 unq 8 iso 0 dist 6.94319 7.47327 9.81593 5.76518 5.57515 12.2338 numMergedOcc 0
43 mol 252 unq 9 iso 0 dist 6.94319 7.47327 9.81593 7.48536 8.28694 14.2535 numMergedOcc 0
44 mol 252 unq 10 iso 0 dist 6.94319 12.2701 9.78248 8.26489 5.2361 12.8039 numMergedOcc 0
45 mol 252 unq 11 iso 0 dist 6.94319 12.2701 9.78248 5.76518 5.57515 8.32839 numMergedOcc 0
46 mol 252 unq 12 iso 0 dist 6.94319 12.2701 9.78248 7.48536 8.28694 5.63228 numMergedOcc 0
47 mol 270 unq 0 iso 0 dist 8.2483 8.39676 8.05859 8.04907 6.31869 12.734 numMergedOcc 0
