0 mol 5 unq 0 iso 0 dist 6.46284 5.28962 7.95876 4.07888 4.98321 4.21127 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 5.19462 7.23774 6.66407 6.11363 9.50614 11.4153 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 5.19462 7.23774 6.66407 10.4149 8.34145 4.96926 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 8.65122 14.1823 9.03564 6.62543 8.77529 9.96534 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 5.73075 7.35881 6.56212 11.7825 8.66724 6.08003 numMergedOcc 0
5 mol 95 unq 0 iso 0 dist 9.05612 6.40193 9.3948 10.6401 8.75345 13.086 numMergedOcc 0
6 mol 105 unq 0 iso 0 dist 9.74162 6.06944 9.16718 6.65185 9.17843 4.4598 numMergedOcc 0
7 mol 105 unq 1 iso 0 dist 9.74162 10.5797 7.94633 6.65185 9.17843 8.50101 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 9.74956 9.72682 7.7988 7.04523 6.96745 11.0625 numMergedOcc 0
9 mol 112 unq 1 iso 0 dist 9.74956 14.4313 9.40824 7.04523 6.96745 14.5726 numMergedOcc 0
10 mol 112 unq 2 iso 0 dist 9.74956 11.8409 4.22363 7.04523 6.96745 9.05551 numMergedOcc 0
11 mol 112 unq 3 iso 0 dist 6.93938 11.3081 7.7988 6.00039 6.96745 11.0625 numMergedOcc 0
12 mol 112 unq 4 iso 0 dist 6.93938 14.7352 9.40824 6.00039 6.96745 14.5726 numMergedOcc 0
13 mol 112 unq 5 iso 0 dist 6.93938 10.7105 4.22363 6.00039 6.96745 9.05551 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 6.89441 11.4807 9.10817 4.92048 6.69042 9.61454 numMergedOcc 0
15 mol 197 unq 1 iso 0 dist 6.89441 7.08995 6.86828 4.92048 6.69042 7.59871 numMergedOcc 0
16 mol 198 unq 0 iso 0 dist 9.42723 15.4671 9.31526 5.9839 9.91727 12.1607 numMergedOcc 0
17 mol 198 unq 1 iso 0 dist 7.70823 15.0288 9.31526 12.5506 9.91727 12.1607 numMergedOcc 0
18 mol 198 unq 2 iso 0 dist 8.16611 9.3872 9.31526 10.8876 9.91727 12.1607 numMergedOcc 0
19 mol 284 unq 0 iso 0 dist 7.21255 8.18513 9.19921 11.6294 9.69019 11.7046 numMergedOcc 0
20 mol 284 unq 1 iso 0 dist 7.21255 5.32637 6.41303 11.6294 9.69019 7.70187 numMergedOcc 0
21 mol 292 unq 0 iso 0 dist 7.18462 9.32514 9.46442 10.2114 9.23612 17.5073 numMergedOcc 0
