0 mol 20 unq 0 iso 0 dist 9.62492 9.88078 14.0866 14.0926 19.6364 7.68085 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 9.62492 7.53599 14.4699 14.0926 19.6364 8.45034 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 8.67226 9.88078 6.48654 14.0926 13.1018 7.68085 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 8.67226 7.53599 8.39164 14.0926 13.1018 8.45034 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 9.12062 6.20159 10.4051 6.87212 11.5251 6.44363 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 9.75708 6.35752 12.3421 6.61758 13.5074 7.70787 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 9.75708 8.88238 11.0685 6.61758 13.5074 9.57191 numMergedOcc 0
7 mol 105 unq 0 iso 0 dist 9.46876 5.84385 7.27819 8.06827 14.66 8.03876 numMergedOcc 0
8 mol 108 unq 0 iso 0 dist 9.42467 6.85803 6.62209 4.89603 9.62124 9.10985 numMergedOcc 0
9 mol 108 unq 1 iso 0 dist 9.42467 5.64136 4.3192 4.89603 9.62124 6.23711 numMergedOcc 0
10 mol 154 unq 0 iso 0 dist 9.71025 5.7306 10.3934 13.0181 17.1553 9.19804 numMergedOcc 0
11 mol 165 unq 0 iso 0 dist 9.13914 9.83155 3.91877 7.37861 7.65047 5.94867 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 9.08229 7.71402 11.7541 4.88159 9.763 6.00793 numMergedOcc 0
13 mol 167 unq 1 iso 0 dist 7.99057 7.71402 13.2159 4.88159 12.538 6.00793 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 8.95136 6.254 12.6877 5.82036 12.5832 9.67328 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 9.45685 9.95473 4.41915 5.17102 6.15713 8.4485 numMergedOcc 0
16 mol 292 unq 0 iso 0 dist 8.1804 5.61843 6.72653 8.56129 11.2973 8.25719 numMergedOcc 0
17 mol 292 unq 1 iso 0 dist 6.76034 5.61843 3.41551 8.56129 7.7557 8.25719 numMergedOcc 0
