0 mol 21 unq 0 iso 0 dist 6.29808 7.46409 5.3862 5.13371 7.05407 9.6925 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 6.29808 8.99131 10.2516 5.13371 7.05407 13.8595 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.93454 9.06898 3.39994 12.5404 7.01952 4.58552 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 9.06898 7.93454 3.39994 12.5404 4.58552 7.01952 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 8.52697 9.66612 3.78041 3.89377 8.64934 11.1204 numMergedOcc 0
5 mol 79 unq 1 iso 0 dist 9.15081 8.7452 5.92995 7.18166 7.20211 9.87994 numMergedOcc 0
6 mol 89 unq 0 iso 0 dist 7.06277 9.55954 7.04263 12.0097 8.05579 12.9299 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 9.61144 6.13521 6.02822 13.5622 9.99441 13.7026 numMergedOcc 0
8 mol 93 unq 0 iso 0 dist 5.46186 9.43355 13.3531 6.81453 7.23305 11.9048 numMergedOcc 0
9 mol 93 unq 1 iso 0 dist 5.46186 5.64141 10.7398 6.81453 7.23305 10.293 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 9.21978 6.17349 11.044 3.85674 7.65564 9.0534 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.22792 7.85696 5.14122 5.44287 5.67168 7.74579 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 9.22792 5.00402 6.05141 5.44287 5.67168 5.86483 numMergedOcc 0
13 mol 186 unq 2 iso 0 dist 9.22792 6.17773 10.3651 5.44287 5.67168 9.89802 numMergedOcc 0
14 mol 186 unq 3 iso 0 dist 7.85696 9.22792 5.14122 5.44287 7.74579 5.67168 numMergedOcc 0
15 mol 186 unq 4 iso 0 dist 7.85696 5.00402 3.51591 5.44287 7.74579 5.86483 numMergedOcc 0
16 mol 186 unq 5 iso 0 dist 7.85696 6.17773 5.93109 5.44287 7.74579 9.89802 numMergedOcc 0
17 mol 186 unq 6 iso 0 dist 5.00402 9.22792 6.05141 5.7782 8.36129 9.17755 numMergedOcc 0
18 mol 186 unq 7 iso 0 dist 5.00402 9.22792 6.05141 5.44287 5.86483 5.67168 numMergedOcc 0
19 mol 186 unq 8 iso 0 dist 5.00402 7.85696 3.51591 5.7782 8.36129 10.8869 numMergedOcc 0
20 mol 186 unq 9 iso 0 dist 5.00402 7.85696 3.51591 5.44287 5.86483 7.74579 numMergedOcc 0
21 mol 186 unq 10 iso 0 dist 5.00402 6.17773 5.07933 5.7782 8.36129 11.6274 numMergedOcc 0
22 mol 186 unq 11 iso 0 dist 5.00402 6.17773 5.07933 5.44287 5.86483 9.89802 numMergedOcc 0
23 mol 213 unq 0 iso 0 dist 5.81317 9.27411 3.48075 6.49084 7.90657 10.0722 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 8.79662 6.6497 4.79329 5.03056 5.72 6.84052 numMergedOcc 0
25 mol 222 unq 1 iso 0 dist 6.6497 8.79662 4.79329 5.03056 6.84052 5.72 numMergedOcc 0
26 mol 222 unq 2 iso 0 dist 6.6497 8.79662 4.79329 3.91348 9.58086 10.6631 numMergedOcc 0
27 mol 235 unq 0 iso 0 dist 9.20504 6.15704 5.20556 5.66713 8.85214 5.1874 numMergedOcc 0
28 mol 235 unq 1 iso 0 dist 6.15704 9.20504 5.20556 9.92254 6.03081 9.34195 numMergedOcc 0
29 mol 235 unq 2 iso 0 dist 6.15704 9.20504 5.20556 5.66713 5.1874 8.85214 numMergedOcc 0
30 mol 243 unq 0 iso 0 dist 9.49016 8.92798 6.26616 12.1329 8.30024 13.6993 numMergedOcc 0
31 mol 243 unq 1 iso 0 dist 9.49016 8.92798 6.26616 6.41173 8.20943 11.5417 numMergedOcc 0
32 mol 251 unq 0 iso 0 dist 8.99048 7.96982 3.63976 15.6828 9.02417 12.5936 numMergedOcc 0
33 mol 292 unq 0 iso 0 dist 9.65996 9.13412 4.99426 6.49965 6.22943 9.23612 numMergedOcc 0
34 mol 292 unq 1 iso 0 dist 9.65996 9.13412 4.99426 12.2613 9.31056 13.842 numMergedOcc 0
35 mol 292 unq 2 iso 0 dist 9.13412 9.65996 4.99426 6.49965 9.23612 6.22943 numMergedOcc 0
