0 mol 7 unq 0 iso 0 dist 9.14481 9.76007 13.5229 9.9698 8.41585 7.78327 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 8.55448 5.34687 9.68636 5.40479 4.61088 6.84216 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 7.11094 8.43668 8.29813 6.59988 5.08437 7.92856 numMergedOcc 0
3 mol 98 unq 1 iso 0 dist 7.11094 8.64195 15.4694 6.59988 5.08437 13.328 numMergedOcc 0
4 mol 98 unq 2 iso 0 dist 7.21175 8.43668 13.2057 6.59988 6.48948 7.92856 numMergedOcc 0
5 mol 98 unq 3 iso 0 dist 7.21175 8.64195 9.71703 6.59988 6.48948 13.328 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 6.70974 6.49185 5.37655 7.84178 5.86073 7.02367 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 7.37883 8.41089 5.46207 7.56889 5.86073 9.30832 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 6.83313 9.62602 10.2024 4.97123 8.14887 5.39356 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 4.84594 9.62602 12.7606 4.97123 9.30299 5.39356 numMergedOcc 0
10 mol 169 unq 0 iso 0 dist 6.67261 6.7265 5.38859 11.0609 8.49164 11.7009 numMergedOcc 0
11 mol 175 unq 0 iso 0 dist 8.16238 9.42155 12.5746 8.65428 5.6234 12.7901 numMergedOcc 0
12 mol 175 unq 1 iso 0 dist 8.16238 9.42155 12.5746 14.5429 9.92231 20.1806 numMergedOcc 0
13 mol 175 unq 2 iso 0 dist 9.88039 9.65391 11.2868 12.7327 9.0018 13.2856 numMergedOcc 0
14 mol 175 unq 3 iso 0 dist 9.88039 9.65391 11.2868 12.0917 5.6234 15.0716 numMergedOcc 0
15 mol 175 unq 4 iso 0 dist 9.88039 9.65391 11.2868 7.46731 6.57069 13.439 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 9.36119 8.18859 5.97386 8.13646 5.30224 8.25897 numMergedOcc 0
17 mol 272 unq 0 iso 0 dist 7.22413 6.07842 5.00122 6.54153 8.48753 10.0612 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 7.144 4.68425 7.75371 6.7906 9.7748 5.69112 numMergedOcc 0
19 mol 277 unq 1 iso 0 dist 7.144 6.46232 11.3546 6.7906 9.7748 7.2091 numMergedOcc 0
