0 mol 30 unq 0 iso 0 dist 3.68549 6.21952 6.88974 5.06613 5.5814 7.5925 numMergedOcc 0
1 mol 30 unq 0 iso 1 dist 3.68549 5.06613 5.5814 6.21952 6.88974 7.5925 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 9.83528 13.0144 5.9747 10.11 4.50572 4.24815 numMergedOcc 0
3 mol 98 unq 0 iso 1 dist 9.83528 10.11 4.50572 13.0144 5.9747 4.24815 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 7.54969 12.9828 5.9747 9.82501 4.50572 4.24815 numMergedOcc 0
5 mol 98 unq 1 iso 1 dist 7.54969 9.82501 4.50572 12.9828 5.9747 4.24815 numMergedOcc 0
6 mol 110 unq 0 iso 0 dist 7.77678 4.9839 9.73174 4.36119 9.65418 4.37555 numMergedOcc 0
7 mol 110 unq 0 iso 1 dist 7.77678 4.36119 9.65418 4.9839 9.73174 4.37555 numMergedOcc 0
8 mol 122 unq 0 iso 0 dist 8.47907 5.08302 9.40018 11.2519 6.78949 9.50688 numMergedOcc 0
9 mol 122 unq 0 iso 1 dist 8.47907 11.2519 6.78949 5.08302 9.40018 9.50688 numMergedOcc 0
10 mol 235 unq 0 iso 0 dist 7.8128 12.3178 9.11256 4.27313 7.08539 13.6805 numMergedOcc 0
11 mol 235 unq 0 iso 1 dist 7.8128 4.27313 7.08539 12.3178 9.11256 13.6805 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 8.95071 9.48296 5.66569 5.05085 6.11137 5.26871 numMergedOcc 0
13 mol 236 unq 0 iso 1 dist 8.95071 5.05085 6.11137 9.48296 5.66569 5.26871 numMergedOcc 0
14 mol 236 unq 1 iso 0 dist 7.49412 10.8749 7.89744 7.38199 8.6417 8.96137 numMergedOcc 0
15 mol 236 unq 1 iso 1 dist 7.49412 7.38199 8.6417 10.8749 7.89744 8.96137 numMergedOcc 0
16 mol 237 unq 0 iso 0 dist 9.59483 13.1097 8.56463 18.3553 9.42743 15.4427 numMergedOcc 0
17 mol 237 unq 0 iso 1 dist 9.59483 18.3553 9.42743 13.1097 8.56463 15.4427 numMergedOcc 0
18 mol 237 unq 1 iso 0 dist 8.42717 11.2515 8.56463 6.24855 9.42743 15.4427 numMergedOcc 0
19 mol 237 unq 1 iso 1 dist 8.42717 6.24855 9.42743 11.2515 8.56463 15.4427 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 7.151 12.4082 9.77689 7.47195 8.51931 13.7559 numMergedOcc 0
21 mol 277 unq 0 iso 1 dist 7.151 7.47195 8.51931 12.4082 9.77689 13.7559 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 8.33977 14.7999 9.77689 5.65499 8.51931 13.7559 numMergedOcc 0
23 mol 277 unq 1 iso 1 dist 8.33977 5.65499 8.51931 14.7999 9.77689 13.7559 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 7.95849 8.55612 9.53313 4.91435 7.26542 3.73926 numMergedOcc 0
25 mol 287 unq 0 iso 1 dist 7.95849 4.91435 7.26542 8.55612 9.53313 3.73926 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 7.95849 8.55612 9.53313 4.91435 7.26542 3.73926 numMergedOcc 0
27 mol 288 unq 0 iso 1 dist 7.95849 4.91435 7.26542 8.55612 9.53313 3.73926 numMergedOcc 0
28 mol 289 unq 0 iso 0 dist 7.95849 8.55612 9.53313 4.91435 7.26542 3.73926 numMergedOcc 0
29 mol 289 unq 0 iso 1 dist 7.95849 4.91435 7.26542 8.55612 9.53313 3.73926 numMergedOcc 0
