0 mol 11 unq 0 iso 0 dist 9.88519 8.89652 8.06254 5.61631 8.70462 7.85023 numMergedOcc 0
1 mol 11 unq 0 iso 1 dist 8.06254 8.89652 9.88519 7.85023 8.70462 5.61631 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 5.80623 11.3613 7.24775 5.45556 7.45532 14.2929 numMergedOcc 0
3 mol 27 unq 0 iso 1 dist 7.24775 11.3613 5.80623 14.2929 7.45532 5.45556 numMergedOcc 0
4 mol 28 unq 0 iso 0 dist 6.68029 9.01928 6.44166 5.63384 7.40415 12.2072 numMergedOcc 0
5 mol 28 unq 0 iso 1 dist 6.44166 9.01928 6.68029 12.2072 7.40415 5.63384 numMergedOcc 0
6 mol 100 unq 0 iso 0 dist 8.22984 5.35519 6.6157 6.16378 9.5669 5.69359 numMergedOcc 0
7 mol 100 unq 0 iso 1 dist 6.6157 5.35519 8.22984 5.69359 9.5669 6.16378 numMergedOcc 0
8 mol 100 unq 1 iso 0 dist 8.22984 9.94989 7.37771 6.16378 9.5669 10.1726 numMergedOcc 0
9 mol 100 unq 1 iso 1 dist 7.37771 9.94989 8.22984 10.1726 9.5669 6.16378 numMergedOcc 0
10 mol 100 unq 1 iso 0 dist 6.6157 5.0211 7.37771 5.69359 9.5669 10.1726 numMergedOcc 0
11 mol 100 unq 1 iso 1 dist 7.37771 5.0211 6.6157 10.1726 9.5669 5.69359 numMergedOcc 0
12 mol 120 unq 0 iso 0 dist 8.41086 10.4469 7.41599 6.69527 6.03352 6.25626 numMergedOcc 0
13 mol 120 unq 0 iso 1 dist 7.41599 10.4469 8.41086 6.25626 6.03352 6.69527 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 9.45931 15.437 6.49728 12.0446 6.73983 6.27844 numMergedOcc 0
15 mol 141 unq 0 iso 1 dist 6.49728 15.437 9.45931 6.27844 6.73983 12.0446 numMergedOcc 0
16 mol 141 unq 1 iso 0 dist 9.45931 15.437 6.49728 15.1652 8.6387 6.2491 numMergedOcc 0
17 mol 141 unq 1 iso 1 dist 6.49728 15.437 9.45931 6.2491 8.6387 15.1652 numMergedOcc 0
18 mol 196 unq 0 iso 0 dist 5.21339 8.14731 6.34867 8.34009 9.76411 11.9044 numMergedOcc 0
19 mol 196 unq 0 iso 1 dist 6.34867 8.14731 5.21339 11.9044 9.76411 8.34009 numMergedOcc 0
20 mol 253 unq 0 iso 0 dist 7.06589 11.7205 8.70383 5.37783 8.15091 14.5125 numMergedOcc 0
21 mol 253 unq 0 iso 1 dist 8.70383 11.7205 7.06589 14.5125 8.15091 5.37783 numMergedOcc 0
22 mol 256 unq 0 iso 0 dist 8.95444 11.8501 7.53508 7.41011 8.89892 11.8833 numMergedOcc 0
23 mol 256 unq 0 iso 1 dist 7.53508 11.8501 8.95444 11.8833 8.89892 7.41011 numMergedOcc 0
24 mol 272 unq 0 iso 0 dist 5.9131 13.7606 8.16917 7.94696 8.13034 12.6613 numMergedOcc 0
25 mol 272 unq 0 iso 1 dist 8.16917 13.7606 5.9131 12.6613 8.13034 7.94696 numMergedOcc 0
26 mol 278 unq 0 iso 0 dist 9.58671 9.84223 8.60481 5.37654 7.21972 9.21229 numMergedOcc 0
27 mol 278 unq 0 iso 1 dist 8.60481 9.84223 9.58671 9.21229 7.21972 5.37654 numMergedOcc 0
