0 mol 28 unq 0 iso 0 dist 9.41374 11.7352 9.56722 15.0747 8.53424 10.8301 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 9.41374 11.7352 9.56722 15.2677 7.08766 10.0008 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 9.41374 11.7352 9.56722 12.524 4.82199 7.55139 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 8.54309 5.35686 6.35997 5.3031 4.75881 6.66835 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 7.83023 12.1742 9.44 7.02956 5.31126 12.8761 numMergedOcc 0
5 mol 113 unq 1 iso 0 dist 7.83023 12.1742 9.44 5.49918 4.49669 7.68828 numMergedOcc 0
6 mol 113 unq 2 iso 0 dist 7.83023 12.1742 9.44 4.25595 6.00221 8.44413 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 8.84651 10.4481 7.41568 11.179 5.36214 3.61945 numMergedOcc 0
8 mol 123 unq 1 iso 0 dist 7.18063 5.92594 8.09682 6.98644 5.56127 3.61945 numMergedOcc 0
9 mol 123 unq 2 iso 0 dist 9.4901 5.92594 7.41568 6.98644 5.36214 3.61945 numMergedOcc 0
10 mol 233 unq 0 iso 0 dist 9.90853 8.75653 8.7499 5.03078 9.80479 5.97893 numMergedOcc 0
11 mol 266 unq 0 iso 0 dist 8.79185 14.4546 7.43884 5.6331 7.80711 11.4637 numMergedOcc 0
12 mol 266 unq 1 iso 0 dist 8.79185 14.4546 7.43884 9.69447 9.9965 12.3524 numMergedOcc 0
13 mol 281 unq 0 iso 0 dist 3.81829 8.24743 9.05453 10.2903 7.90368 16.2801 numMergedOcc 0
14 mol 281 unq 1 iso 0 dist 3.81829 8.24743 9.05453 9.01939 6.69267 9.81081 numMergedOcc 0
15 mol 281 unq 2 iso 0 dist 4.69609 11.2981 9.05453 8.13312 7.90368 16.2801 numMergedOcc 0
16 mol 281 unq 3 iso 0 dist 4.69609 11.2981 9.05453 5.07206 6.69267 9.81081 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 8.98138 4.75062 8.4625 10.0104 4.68668 11.4589 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 8.98138 4.75062 8.4625 10.0104 4.68668 11.4589 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 8.98138 4.75062 8.4625 10.0104 4.68668 11.4589 numMergedOcc 0
