0 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 9.87885 12.8323 7.92429 10.2446 7.88043 7.45262 8.15894 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.41585 6.36911 6.06176 9.87885 12.8323 7.92429 12.3097 8.80762 6.96586 8.45544 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.10621 7.31201 10.789 6.1206 7.12508 4.40641 5.44992 5.72491 9.55056 8.15894 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.10621 7.31201 10.789 7.67927 11.143 5.03278 5.44992 5.72491 9.55056 11.7902 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 7.10621 9.36807 10.515 6.1206 7.12508 7.92429 5.44992 5.72491 7.45262 8.15894 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 7.10621 9.36807 10.515 7.67927 11.143 11.2233 5.44992 5.72491 7.45262 11.7902 numMergedOcc 0
6 mol 9 unq 0 iso 0 dist 8.57077 8.47421 5.60154 8.55451 8.69454 5.66192 3.98483 9.78006 8.04924 9.64824 numMergedOcc 0
7 mol 9 unq 1 iso 0 dist 8.57077 8.47421 5.60154 5.8245 5.84314 3.91075 3.98483 9.78006 8.04924 7.05919 numMergedOcc 0
8 mol 16 unq 0 iso 0 dist 7.63133 5.47769 5.94084 8.43054 9.81307 4.68733 10.454 6.56335 11.6017 15.8645 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 5.83991 7.76729 10.9739 6.24825 6.01673 5.78043 6.4497 5.72642 14.0242 10.6602 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 6.11741 9.66954 4.61908 6.39384 6.07067 6.49835 6.08806 5.74857 9.62857 10.3973 numMergedOcc 0
11 mol 115 unq 2 iso 0 dist 6.11741 7.64585 10.8939 6.39384 6.07067 5.65471 6.08806 5.74857 13.5029 10.3973 numMergedOcc 0
12 mol 115 unq 3 iso 0 dist 7.88312 8.66155 4.61908 7.69765 11.835 9.13361 7.21418 5.74857 9.62857 14.0614 numMergedOcc 0
13 mol 115 unq 4 iso 0 dist 7.88312 8.66155 4.61908 9.42082 6.07067 6.49835 7.21418 5.74857 9.62857 10.3973 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 9.29945 9.52634 9.11521 9.63417 11.0361 4.14392 4.24624 8.0154 12.0318 12.349 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 5.59424 8.36822 5.71262 9.78634 9.53265 10.3099 7.0057 7.24199 8.53433 15.493 numMergedOcc 0
16 mol 192 unq 1 iso 0 dist 5.59424 8.36822 5.71262 5.64942 6.35474 10.1087 7.0057 7.24199 8.53433 11.7494 numMergedOcc 0
17 mol 192 unq 2 iso 0 dist 5.59424 8.36822 5.71262 7.43054 5.25965 10.0566 7.0057 7.24199 8.53433 11.7133 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 6.03031 9.19704 8.66809 6.52816 9.49403 13.4094 5.28092 8.44861 5.42696 10.183 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 7.26832 9.19704 6.23291 6.52816 13.514 13.4094 5.28092 5.60393 5.42696 10.183 numMergedOcc 0
20 mol 227 unq 0 iso 0 dist 7.22101 8.17891 6.43754 5.23634 5.0317 4.09934 10.5813 8.03442 7.1372 9.43618 numMergedOcc 0
21 mol 227 unq 1 iso 0 dist 8.65997 9.62609 14.6185 6.91318 5.0317 11.5454 7.22396 8.03442 10.841 9.43618 numMergedOcc 0
22 mol 227 unq 2 iso 0 dist 8.65997 6.95902 6.43754 6.91318 5.0317 4.09934 7.22396 8.03442 7.1372 9.43618 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 7.31233 6.55759 10.4664 9.12776 10.3162 15.4844 7.83352 5.64181 8.6597 12.1568 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 7.31233 7.02475 11.2717 9.12776 10.3162 13.037 7.83352 5.64181 7.47235 12.1568 numMergedOcc 0
25 mol 238 unq 2 iso 0 dist 7.31233 7.67322 12.6986 9.12776 10.3162 9.75095 7.83352 5.64181 10.3116 12.1568 numMergedOcc 0
26 mol 238 unq 3 iso 0 dist 7.31233 7.19008 5.17471 9.12776 10.3162 6.12722 7.83352 5.64181 6.44735 12.1568 numMergedOcc 0
27 mol 259 unq 0 iso 0 dist 7.46176 7.48005 5.79468 9.63573 5.21606 9.98303 5.60748 8.55558 6.39918 12.8954 numMergedOcc 0
28 mol 259 unq 1 iso 0 dist 7.46176 7.48005 5.79468 7.66153 11.8896 14.0829 5.60748 8.55558 6.39918 13.1388 numMergedOcc 0
