0 mol 0 unq 0 iso 0 dist 8.24206 6.19218 9.98828 5.25456 7.37981 7.19621 numMergedOcc 0
1 mol 0 unq 0 iso 1 dist 6.19218 8.24206 9.98828 5.25456 7.19621 7.37981 numMergedOcc 0
2 mol 2 unq 0 iso 0 dist 9.08872 9.74371 6.23988 9.97525 9.58976 6.35342 numMergedOcc 0
3 mol 2 unq 0 iso 1 dist 9.74371 9.08872 6.23988 9.97525 6.35342 9.58976 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 8.30431 4.628 8.0979 6.32949 9.62468 5.92705 numMergedOcc 0
5 mol 61 unq 0 iso 1 dist 4.628 8.30431 8.0979 6.32949 5.92705 9.62468 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 5.39171 9.27355 5.47475 10.5627 6.89722 7.26679 numMergedOcc 0
7 mol 73 unq 0 iso 1 dist 9.27355 5.39171 5.47475 10.5627 7.26679 6.89722 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 9.27355 8.60363 4.4628 10.8067 9.68526 9.72442 numMergedOcc 0
9 mol 73 unq 1 iso 1 dist 8.60363 9.27355 4.4628 10.8067 9.72442 9.68526 numMergedOcc 0
10 mol 108 unq 0 iso 0 dist 9.32474 8.80334 6.45014 5.60268 7.29462 5.4057 numMergedOcc 0
11 mol 108 unq 0 iso 1 dist 8.80334 9.32474 6.45014 5.60268 5.4057 7.29462 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 6.21546 6.03184 7.01839 5.73338 8.69888 5.08206 numMergedOcc 0
13 mol 175 unq 0 iso 1 dist 6.03184 6.21546 7.01839 5.73338 5.08206 8.69888 numMergedOcc 0
14 mol 194 unq 0 iso 0 dist 7.38622 8.82165 4.87816 5.55582 7.32478 9.48439 numMergedOcc 0
15 mol 194 unq 0 iso 1 dist 8.82165 7.38622 4.87816 5.55582 9.48439 7.32478 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 6.6537 9.08719 11.6002 4.55824 9.75313 6.08709 numMergedOcc 0
17 mol 224 unq 0 iso 1 dist 9.08719 6.6537 11.6002 4.55824 6.08709 9.75313 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 6.74214 5.33462 4.85921 6.3873 9.31417 5.56719 numMergedOcc 0
19 mol 238 unq 0 iso 1 dist 5.33462 6.74214 4.85921 6.3873 5.56719 9.31417 numMergedOcc 0
20 mol 249 unq 0 iso 0 dist 6.18866 9.3807 5.2966 12.5843 7.29898 8.91685 numMergedOcc 0
21 mol 249 unq 0 iso 1 dist 9.3807 6.18866 5.2966 12.5843 8.91685 7.29898 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 9.07452 7.21004 10.3541 6.11218 7.80446 9.91395 numMergedOcc 0
23 mol 274 unq 0 iso 1 dist 7.21004 9.07452 10.3541 6.11218 9.91395 7.80446 numMergedOcc 0
24 mol 274 unq 1 iso 0 dist 6.44266 8.75703 10.3541 6.98398 7.80446 9.91395 numMergedOcc 0
25 mol 274 unq 1 iso 1 dist 8.75703 6.44266 10.3541 6.98398 9.91395 7.80446 numMergedOcc 0
