0 mol 17 unq 0 iso 0 dist 7.30541 4.20667 9.65377 5.22923 8.55161 5.09467 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 9.26043 4.44768 6.64564 5.86778 9.52717 3.86331 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 8.73923 13.6772 9.65672 11.09 7.61377 10.6356 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 7.10403 4.40557 9.1662 11.1855 7.85738 14.4144 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 7.67696 4.06151 8.29328 10.8259 7.17133 9.02053 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 9.41313 9.08111 8.09675 5.21816 9.85386 11.1342 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 9.41313 9.08111 8.09675 8.82709 4.8983 8.22845 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 9.41313 5.88754 9.02753 5.21816 9.85386 10.0544 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 9.41313 5.88754 9.02753 8.82709 4.8983 6.96897 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 8.54948 10.4467 5.74637 9.17488 5.6516 4.56066 numMergedOcc 0
10 mol 104 unq 0 iso 0 dist 7.15143 5.23957 8.44663 4.07581 9.43136 3.41728 numMergedOcc 0
11 mol 123 unq 0 iso 0 dist 7.99359 4.99882 8.56386 7.21006 8.40918 10.941 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 7.28273 4.65559 7.13958 3.50174 4.4077 3.54691 numMergedOcc 0
13 mol 129 unq 1 iso 0 dist 7.28273 4.65559 7.13958 3.98945 8.4874 5.56761 numMergedOcc 0
14 mol 131 unq 0 iso 0 dist 8.89564 4.26345 9.09918 5.906 7.75833 5.78374 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 8.13344 6.45157 4.69402 4.88335 6.67937 5.56456 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 5.68406 10.2381 9.28415 6.8842 9.57243 15.6885 numMergedOcc 0
17 mol 141 unq 1 iso 0 dist 5.68406 10.2381 9.28415 6.46148 8.12558 7.06015 numMergedOcc 0
18 mol 141 unq 2 iso 0 dist 9.46329 16.7513 9.28415 5.05002 9.57243 15.6885 numMergedOcc 0
19 mol 141 unq 3 iso 0 dist 9.46329 16.7513 9.28415 12.4824 8.12558 7.06015 numMergedOcc 0
20 mol 151 unq 0 iso 0 dist 8.15628 4.20596 5.62891 6.07474 9.00461 3.96406 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 8.72113 7.45659 5.83898 4.90099 5.97886 3.85596 numMergedOcc 0
22 mol 204 unq 0 iso 0 dist 7.30459 11.3783 8.40718 8.62729 8.77524 16.6893 numMergedOcc 0
23 mol 204 unq 1 iso 0 dist 8.73423 4.92057 8.40718 16.3802 8.77524 16.6893 numMergedOcc 0
24 mol 233 unq 0 iso 0 dist 6.50096 3.63541 8.20598 6.41178 8.2484 3.4982 numMergedOcc 0
25 mol 233 unq 1 iso 0 dist 9.91416 6.30963 8.20598 9.33444 8.2484 3.4982 numMergedOcc 0
26 mol 246 unq 0 iso 0 dist 8.94816 9.41084 9.22642 4.83796 9.03834 6.04606 numMergedOcc 0
27 mol 246 unq 1 iso 0 dist 8.94816 5.6775 7.63397 4.83796 9.03834 8.86898 numMergedOcc 0
28 mol 252 unq 0 iso 0 dist 7.50015 9.15581 8.99368 3.94102 8.99666 10.0331 numMergedOcc 0
29 mol 252 unq 1 iso 0 dist 8.33933 6.36131 8.99368 7.98948 8.99666 10.0331 numMergedOcc 0
30 mol 252 unq 2 iso 0 dist 5.95029 5.86631 8.99368 11.4978 8.99666 10.0331 numMergedOcc 0
31 mol 253 unq 0 iso 0 dist 8.2681 4.69007 8.32005 6.93425 6.74521 7.03949 numMergedOcc 0
32 mol 258 unq 0 iso 0 dist 9.44669 14.7095 9.46746 13.9996 9.48672 3.78294 numMergedOcc 0
33 mol 258 unq 1 iso 0 dist 9.44669 9.9782 7.31698 13.9996 9.48672 5.23608 numMergedOcc 0
34 mol 287 unq 0 iso 0 dist 9.04355 12.8871 6.76192 4.12505 9.31611 11.7613 numMergedOcc 0
35 mol 288 unq 0 iso 0 dist 9.04355 12.8871 6.76192 4.12505 9.31611 11.7613 numMergedOcc 0
36 mol 289 unq 0 iso 0 dist 9.04355 12.8871 6.76192 4.12505 9.31611 11.7613 numMergedOcc 0
37 mol 293 unq 0 iso 0 dist 7.77847 10.5262 6.97887 7.73876 7.15948 5.93756 numMergedOcc 0
38 mol 294 unq 0 iso 0 dist 9.23009 9.32276 5.71656 10.0567 8.32582 3.83842 numMergedOcc 0
