0 mol 34 unq 0 iso 0 dist 9.3613 8.8717 17.5627 7.66913 14.1987 12.5406 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 7.32436 6.22124 7.34525 9.46449 7.13002 13.1663 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 9.26484 9.33262 14.3985 5.76805 5.75083 8.75516 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 7.6886 8.39026 12.5938 8.51206 6.21014 10.9279 numMergedOcc 0
4 mol 128 unq 0 iso 0 dist 9.82711 7.90691 12.0449 4.89256 11.1068 5.19611 numMergedOcc 0
5 mol 128 unq 1 iso 0 dist 9.82711 8.83011 15.6064 4.89256 11.1068 4.68499 numMergedOcc 0
6 mol 128 unq 2 iso 0 dist 7.94925 9.23513 14.0488 9.95168 16.6305 4.58658 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 8.65807 9.36312 5.32363 7.35647 9.37324 6.85776 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 6.6011 9.70308 8.31794 9.36089 11.6964 7.15463 numMergedOcc 0
9 mol 192 unq 1 iso 0 dist 6.6011 9.70308 8.31794 8.25221 8.7874 10.2652 numMergedOcc 0
10 mol 192 unq 2 iso 0 dist 6.6011 9.70308 8.31794 6.64416 7.84006 6.6067 numMergedOcc 0
11 mol 192 unq 3 iso 0 dist 8.82945 9.70308 9.04353 9.36089 9.74325 7.15463 numMergedOcc 0
12 mol 192 unq 4 iso 0 dist 8.82945 9.70308 9.04353 8.25221 14.0388 10.2652 numMergedOcc 0
13 mol 192 unq 5 iso 0 dist 8.82945 9.70308 9.04353 6.64416 11.6621 6.6067 numMergedOcc 0
14 mol 195 unq 0 iso 0 dist 8.3941 8.22643 9.48981 5.0778 8.18632 6.74112 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 7.53036 8.65572 11.8096 9.24801 13.6481 15.7583 numMergedOcc 0
16 mol 206 unq 1 iso 0 dist 7.53036 8.39332 10.879 9.24801 13.6481 6.24602 numMergedOcc 0
17 mol 209 unq 0 iso 0 dist 9.20752 9.95951 14.6137 9.17634 7.5627 12.4196 numMergedOcc 0
18 mol 209 unq 1 iso 0 dist 9.20752 6.43914 13.8537 9.17634 7.5627 12.5858 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 5.46484 9.33359 10.151 5.27184 8.52618 5.92456 numMergedOcc 0
20 mol 236 unq 1 iso 0 dist 5.46484 9.33359 10.151 7.98527 5.37989 10.9807 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 9.41633 8.81257 6.86233 9.39578 15.6765 12.5953 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 7.74708 9.06043 4.81101 6.9592 12.0681 15.1214 numMergedOcc 0
23 mol 278 unq 1 iso 0 dist 6.03414 9.06043 9.30287 6.9592 7.3159 15.1214 numMergedOcc 0
24 mol 278 unq 2 iso 0 dist 9.82026 9.06043 16.5354 6.9592 5.36662 15.1214 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 4.98604 9.79154 9.12324 8.25538 12.5027 10.8252 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 4.98604 9.79154 9.12324 8.25538 12.5027 10.8252 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 4.98604 9.79154 9.12324 8.25538 12.5027 10.8252 numMergedOcc 0
