0 mol 26 unq 0 iso 0 dist 7.46207 9.89914 12.8511 7.35595 8.82012 7.84204 numMergedOcc 0
1 mol 39 unq 0 iso 0 dist 5.00126 8.82943 5.20561 6.37567 7.33969 10.5461 numMergedOcc 0
2 mol 39 unq 1 iso 0 dist 5.00126 8.82943 5.20561 5.92759 7.45237 12.2837 numMergedOcc 0
3 mol 45 unq 0 iso 0 dist 9.17045 8.55903 8.61828 10.9036 6.99408 11.5526 numMergedOcc 0
4 mol 70 unq 0 iso 0 dist 7.63663 5.05263 6.93285 14.4842 7.92394 11.2098 numMergedOcc 0
5 mol 70 unq 1 iso 0 dist 7.63663 5.05263 6.93285 14.7467 9.93423 10.6366 numMergedOcc 0
6 mol 70 unq 2 iso 0 dist 7.63663 5.05263 6.93285 5.93792 9.34122 5.48202 numMergedOcc 0
7 mol 72 unq 0 iso 0 dist 6.68311 5.19407 4.7874 13.1473 6.77912 11.0008 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 6.10011 5.7576 3.85805 10.0721 5.64598 7.78587 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 8.124 5.7576 5.17781 10.0721 4.65521 7.78587 numMergedOcc 0
10 mol 79 unq 0 iso 0 dist 6.09906 7.60619 3.83059 12.0756 7.87814 8.58021 numMergedOcc 0
11 mol 102 unq 0 iso 0 dist 9.84673 9.5434 3.48119 7.6114 9.94856 7.68537 numMergedOcc 0
12 mol 124 unq 0 iso 0 dist 6.35314 9.66083 9.79481 9.93612 6.83051 16.142 numMergedOcc 0
13 mol 124 unq 1 iso 0 dist 6.35314 9.66083 9.79481 9.06209 9.28376 17.4719 numMergedOcc 0
14 mol 209 unq 0 iso 0 dist 6.14896 9.81506 11.3631 4.86181 7.95911 14.6568 numMergedOcc 0
15 mol 241 unq 0 iso 0 dist 8.98668 9.87415 17.6924 13.6264 6.83797 22.5923 numMergedOcc 0
16 mol 249 unq 0 iso 0 dist 7.72708 5.7671 5.57138 6.94174 8.96876 10.5843 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 8.57619 9.31843 9.53031 5.4536 8.37865 9.28024 numMergedOcc 0
18 mol 265 unq 0 iso 0 dist 5.3051 8.57848 5.94366 6.10503 6.34034 9.47153 numMergedOcc 0
