0 mol 29 unq 0 iso 0 dist 9.99467 8.03211 9.78134 13.2555 7.29489 9.41017 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.98208 15.1815 7.47162 18.8391 10.5011 8.4701 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 5.55798 10.0025 8.26763 11.9711 9.40625 9.77084 numMergedOcc 0
3 mol 79 unq 1 iso 0 dist 5.55798 6.35003 6.30814 11.9711 9.40625 6.5551 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 5.81553 3.82552 6.6536 9.32042 6.24821 8.06134 numMergedOcc 0
5 mol 112 unq 1 iso 0 dist 5.81553 3.82552 6.6536 8.23777 6.74235 5.36587 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 9.48694 17.5356 8.88752 22.1688 12.8098 8.83732 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 6.65267 3.84992 8.88752 9.58772 12.8098 8.83732 numMergedOcc 0
8 mol 155 unq 0 iso 0 dist 8.02356 5.05961 8.99128 12.8574 11.7393 9.16358 numMergedOcc 0
9 mol 155 unq 1 iso 0 dist 8.02356 5.05961 8.99128 10.463 10.7516 9.24038 numMergedOcc 0
10 mol 159 unq 0 iso 0 dist 7.52779 7.44399 9.45909 15.4591 17.2892 9.35202 numMergedOcc 0
11 mol 168 unq 0 iso 0 dist 5.60956 9.43003 8.18217 12.1714 6.6467 9.85438 numMergedOcc 0
12 mol 168 unq 1 iso 0 dist 5.60956 8.01699 5.51167 12.1714 6.6467 9.42807 numMergedOcc 0
13 mol 170 unq 0 iso 0 dist 9.05865 10.2179 9.66676 9.53158 4.11212 6.47164 numMergedOcc 0
14 mol 170 unq 1 iso 0 dist 9.05865 10.2179 9.66676 12.7875 9.2613 9.65126 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 5.13534 4.76079 5.97971 9.46838 7.18433 5.99437 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 9.35664 14.1853 9.20541 16.7291 8.71774 6.22742 numMergedOcc 0
17 mol 195 unq 1 iso 0 dist 9.35664 6.61517 6.65077 8.13947 7.07871 9.24936 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 4.87053 4.91709 7.99441 5.89818 4.07008 8.43195 numMergedOcc 0
19 mol 222 unq 1 iso 0 dist 4.87053 5.96186 6.71817 5.89818 4.07008 8.23406 numMergedOcc 0
