0 mol 19 unq 0 iso 0 dist 8.0122 5.06566 6.44099 6.50749 7.97324 6.57145 numMergedOcc 0
1 mol 51 unq 0 iso 0 dist 8.07329 5.44083 7.72008 9.56118 7.27272 8.64743 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 5.93859 6.73575 7.89643 5.87231 9.43171 10.9346 numMergedOcc 0
3 mol 127 unq 0 iso 0 dist 9.78695 5.50976 8.04315 10.7122 5.72373 11.5038 numMergedOcc 0
4 mol 127 unq 1 iso 0 dist 9.78695 5.50976 8.04315 13.0671 7.20988 12.1032 numMergedOcc 0
5 mol 135 unq 0 iso 0 dist 9.26975 5.51409 5.10333 4.80364 6.67623 6.06401 numMergedOcc 0
6 mol 135 unq 1 iso 0 dist 9.26975 10.3323 8.17422 4.80364 6.67623 7.14273 numMergedOcc 0
7 mol 198 unq 0 iso 0 dist 5.58323 10.5384 7.66395 5.11128 5.82585 12.2253 numMergedOcc 0
8 mol 206 unq 0 iso 0 dist 7.66485 11.5097 6.39655 13.8408 6.29592 5.91558 numMergedOcc 0
9 mol 206 unq 1 iso 0 dist 7.66485 14.9665 8.05723 13.8408 6.29592 6.28828 numMergedOcc 0
10 mol 206 unq 2 iso 0 dist 7.93662 7.44363 6.39655 11.5281 6.29592 5.91558 numMergedOcc 0
11 mol 206 unq 3 iso 0 dist 7.93662 15.6535 8.05723 11.5281 6.29592 6.28828 numMergedOcc 0
12 mol 206 unq 4 iso 0 dist 9.01256 11.0576 6.39655 12.6137 6.29592 5.91558 numMergedOcc 0
13 mol 206 unq 5 iso 0 dist 9.01256 12.5664 8.05723 12.6137 6.29592 6.28828 numMergedOcc 0
14 mol 211 unq 0 iso 0 dist 7.92033 13.115 9.37348 7.84116 8.34959 8.76573 numMergedOcc 0
15 mol 229 unq 0 iso 0 dist 6.38661 6.09093 7.30641 6.0971 7.77578 6.15024 numMergedOcc 0
16 mol 229 unq 1 iso 0 dist 6.38661 6.09093 7.30641 5.6419 7.38552 10.8972 numMergedOcc 0
17 mol 245 unq 0 iso 0 dist 6.69861 4.54928 9.47849 4.7604 8.49651 8.10086 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 9.82174 10.4623 6.7769 5.58306 9.08128 6.20472 numMergedOcc 0
