0 mol 26 unq 0 iso 0 dist 9.61029 7.54282 7.11305 7.95969 6.73162 9.96121 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 8.28463 9.21811 9.11842 3.71754 9.77484 6.78936 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 8.97292 8.58849 11.3575 9.55542 6.71911 14.7794 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 8.97292 5.73075 13.6023 9.55542 6.71911 14.3547 numMergedOcc 0
4 mol 70 unq 0 iso 0 dist 7.95122 8.55467 8.70781 10.7301 8.33704 14.9918 numMergedOcc 0
5 mol 70 unq 1 iso 0 dist 9.74268 8.55467 13.4238 10.7301 7.92394 14.9918 numMergedOcc 0
6 mol 70 unq 2 iso 0 dist 9.74268 8.55467 13.4238 11.7565 9.93423 17.8512 numMergedOcc 0
7 mol 70 unq 3 iso 0 dist 9.74268 8.55467 13.4238 12.3296 9.34122 19.2734 numMergedOcc 0
8 mol 86 unq 0 iso 0 dist 5.49793 7.19148 5.9022 4.51657 7.79359 5.88159 numMergedOcc 0
9 mol 89 unq 0 iso 0 dist 8.25651 6.00509 6.13636 7.51049 8.75946 9.8042 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.32004 9.9292 6.20019 5.66952 9.38288 12.4009 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 8.32004 9.9292 6.20019 4.91188 6.19042 6.13374 numMergedOcc 0
12 mol 119 unq 2 iso 0 dist 8.32004 9.9292 6.20019 7.01214 7.44174 9.08536 numMergedOcc 0
13 mol 182 unq 0 iso 0 dist 6.31492 8.45614 4.88992 5.37421 6.73313 5.73635 numMergedOcc 0
14 mol 213 unq 0 iso 0 dist 9.06306 7.31478 4.72944 6.32328 8.45368 5.461 numMergedOcc 0
15 mol 218 unq 0 iso 0 dist 5.52981 5.92364 6.04002 10.2333 7.18041 12.9717 numMergedOcc 0
16 mol 218 unq 1 iso 0 dist 5.52981 5.92364 6.04002 6.48676 7.17547 10.6021 numMergedOcc 0
17 mol 218 unq 2 iso 0 dist 6.22077 5.92364 6.45316 6.21463 9.50586 11.9528 numMergedOcc 0
18 mol 218 unq 3 iso 0 dist 6.22077 5.92364 6.45316 6.48676 7.13323 10.6021 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 9.29203 9.97859 16.7443 11.091 9.90142 11.5628 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 7.62771 9.97859 13.1408 12.4266 9.68513 10.0287 numMergedOcc 0
21 mol 238 unq 2 iso 0 dist 7.62771 9.97859 13.1408 11.091 5.9216 11.5628 numMergedOcc 0
22 mol 238 unq 3 iso 0 dist 7.80166 9.97859 10.4706 12.4266 9.29858 10.0287 numMergedOcc 0
23 mol 250 unq 0 iso 0 dist 6.18342 9.41222 9.19059 6.49019 8.80086 13.6779 numMergedOcc 0
24 mol 282 unq 0 iso 0 dist 7.90792 9.07173 5.29852 6.63358 7.32347 7.52924 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 9.26573 7.21255 6.25608 13.5055 8.41504 11.4133 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 6.8133 6.98961 5.50627 8.10093 9.454 12.2657 numMergedOcc 0
