0 mol 26 unq 0 iso 0 dist 9.6643 7.35595 9.25649 7.46207 15.2834 8.82012 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.6643 7.35595 9.25649 15.3546 17.7956 9.16962 numMergedOcc 0
2 mol 39 unq 0 iso 0 dist 8.62842 12.6438 8.19733 16.9247 11.962 7.33969 numMergedOcc 0
3 mol 39 unq 1 iso 0 dist 8.27298 15.6407 8.19733 18.6779 11.962 7.33969 numMergedOcc 0
4 mol 39 unq 2 iso 0 dist 8.56111 16.7059 8.19733 19.9115 11.962 7.33969 numMergedOcc 0
5 mol 74 unq 0 iso 0 dist 9.60205 6.32526 4.79413 14.0363 4.79817 8.96501 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 7.67321 11.1982 6.82089 15.3716 9.44878 6.79146 numMergedOcc 0
7 mol 130 unq 1 iso 0 dist 7.67321 11.1982 6.82089 11.7417 4.28797 7.66168 numMergedOcc 0
8 mol 130 unq 2 iso 0 dist 7.67321 11.1982 6.82089 9.77934 6.97875 6.89257 numMergedOcc 0
9 mol 130 unq 3 iso 0 dist 7.67321 6.1956 5.38314 11.7417 4.28797 9.12581 numMergedOcc 0
10 mol 130 unq 4 iso 0 dist 7.67321 6.1956 5.38314 9.77934 6.97875 8.74308 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 9.95533 15.5982 7.01133 22.5 12.6979 8.33261 numMergedOcc 0
12 mol 147 unq 1 iso 0 dist 7.94147 12.2623 7.01133 15.5444 12.6979 8.33261 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 6.86144 6.23042 7.345 10.1105 5.93488 7.20046 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 6.86144 12.032 9.52987 10.1105 5.93488 7.13543 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 7.30003 5.24956 5.10114 11.5105 5.63388 7.46831 numMergedOcc 0
16 mol 214 unq 1 iso 0 dist 7.30003 5.24956 5.10114 10.1886 6.214 8.60247 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.62121 5.30958 7.61203 11.6421 11.0349 7.67322 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 9.62121 7.68455 9.47845 11.2146 5.87253 9.68513 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 9.62121 7.68455 9.47845 15.8185 10.7551 9.29858 numMergedOcc 0
20 mol 238 unq 3 iso 0 dist 9.62121 6.2139 6.92409 15.8904 10.7508 9.90142 numMergedOcc 0
21 mol 238 unq 4 iso 0 dist 9.62121 6.2139 6.92409 11.2146 5.87253 5.9216 numMergedOcc 0
22 mol 238 unq 5 iso 0 dist 9.62121 12.3809 6.89694 16.4478 13.0113 7.49471 numMergedOcc 0
23 mol 238 unq 6 iso 0 dist 9.62121 12.3809 6.89694 11.6421 11.0349 7.19008 numMergedOcc 0
24 mol 252 unq 0 iso 0 dist 6.97105 5.3935 5.2361 7.93609 5.89666 7.66365 numMergedOcc 0
25 mol 259 unq 0 iso 0 dist 8.30744 5.4536 6.39918 10.367 5.60748 7.48005 numMergedOcc 0
26 mol 259 unq 1 iso 0 dist 8.30744 5.4536 6.39918 8.57619 7.31951 8.37865 numMergedOcc 0
27 mol 272 unq 0 iso 0 dist 4.80092 5.91451 7.55161 7.31993 4.86504 6.16449 numMergedOcc 0
28 mol 278 unq 0 iso 0 dist 9.67619 10.7269 9.48589 13.1685 6.54009 6.35287 numMergedOcc 0
