0 mol 12 unq 0 iso 0 dist 5.76006 5.25583 4.86727 4.12573 4.49007 6.6691 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 5.76006 5.25583 4.86727 5.83262 8.59739 9.23807 numMergedOcc 0
2 mol 12 unq 2 iso 0 dist 5.76006 5.25583 4.86727 10.5333 14.0611 9.52857 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 7.88087 8.34763 8.00875 4.93307 6.69002 5.99176 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 7.88087 5.66008 8.9954 4.93307 6.69002 6.98583 numMergedOcc 0
5 mol 30 unq 0 iso 0 dist 7.75901 9.41816 4.46139 6.51677 9.43959 9.81761 numMergedOcc 0
6 mol 48 unq 0 iso 0 dist 7.77714 7.99735 5.41488 4.31769 6.99001 8.82709 numMergedOcc 0
7 mol 48 unq 1 iso 0 dist 6.46118 9.7516 5.41488 7.10894 6.99001 8.82709 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 8.21723 6.00684 9.59932 6.0425 12.9306 5.72627 numMergedOcc 0
9 mol 79 unq 1 iso 0 dist 8.21723 6.00684 9.59932 11.8739 16.8282 7.68741 numMergedOcc 0
10 mol 79 unq 2 iso 0 dist 8.21723 6.00684 9.59932 12.1206 18.9905 9.86085 numMergedOcc 0
11 mol 79 unq 3 iso 0 dist 8.21723 6.00684 9.59932 11.9735 15.5412 9.76351 numMergedOcc 0
12 mol 124 unq 0 iso 0 dist 5.69775 8.45451 5.26643 4.31676 8.18186 9.5436 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 9.02183 7.90753 5.15002 10.5065 10.9743 9.2933 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 9.02183 7.90753 5.15002 6.04759 6.66608 8.77781 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 7.74423 8.27545 5.21255 5.97774 7.04366 8.29166 numMergedOcc 0
16 mol 192 unq 1 iso 0 dist 7.74423 8.27545 5.21255 15.3045 12.7509 8.14859 numMergedOcc 0
17 mol 192 unq 2 iso 0 dist 7.74423 8.27545 5.21255 11.5774 9.99783 5.62421 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 5.1498 5.77947 5.31074 6.79948 10.8258 9.78347 numMergedOcc 0
19 mol 220 unq 1 iso 0 dist 8.68353 9.92336 3.24077 13.5468 6.88259 9.19001 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 6.02845 7.61854 8.84253 12.8555 13.9789 5.91739 numMergedOcc 0
21 mol 236 unq 1 iso 0 dist 9.35599 7.61854 14.1956 12.8555 19.1939 5.91739 numMergedOcc 0
22 mol 266 unq 0 iso 0 dist 6.55208 7.27283 9.89221 6.33919 10.3937 7.53905 numMergedOcc 0
23 mol 266 unq 1 iso 0 dist 7.17562 8.35447 9.89221 10.4141 10.3937 7.53905 numMergedOcc 0
