0 mol 29 unq 0 iso 0 dist 8.00338 9.56672 8.71044 7.33601 5.34723 10.5066 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 7.61514 8.21116 2.58673 12.3084 5.61151 6.54289 numMergedOcc 0
2 mol 85 unq 1 iso 0 dist 8.21116 7.61514 2.58673 12.3084 6.54289 5.61151 numMergedOcc 0
3 mol 85 unq 2 iso 0 dist 8.21116 7.61514 2.58673 15.5542 7.52869 9.18895 numMergedOcc 0
4 mol 85 unq 3 iso 0 dist 8.21116 7.61514 2.58673 16.0243 9.18945 9.58605 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 5.43098 9.40555 10.6173 5.25762 4.70557 10.5092 numMergedOcc 0
6 mol 88 unq 1 iso 0 dist 5.43098 9.40555 10.6173 11.6458 9.08952 19.5573 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 5.5917 5.24806 3.11116 4.90946 8.86956 9.77106 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 9.54857 8.73456 3.22387 6.32132 9.43419 9.92033 numMergedOcc 0
9 mol 236 unq 0 iso 0 dist 5.09952 8.32786 11.7483 4.99523 7.58569 11.4354 numMergedOcc 0
10 mol 260 unq 0 iso 0 dist 5.33278 7.13397 8.11213 4.91827 5.30187 10.0128 numMergedOcc 0
11 mol 264 unq 0 iso 0 dist 9.05194 9.02526 2.95376 11.4763 8.56867 6.29872 numMergedOcc 0
12 mol 264 unq 1 iso 0 dist 9.02526 9.05194 2.95376 11.4763 6.29872 8.56867 numMergedOcc 0
13 mol 281 unq 0 iso 0 dist 8.78416 9.22428 3.77058 13.4831 9.94612 12.0277 numMergedOcc 0
14 mol 294 unq 0 iso 0 dist 6.82335 7.33086 4.76434 12.7758 9.33755 13.0844 numMergedOcc 0
15 mol 294 unq 1 iso 0 dist 6.82335 7.88971 10.769 12.7758 9.33755 17.4056 numMergedOcc 0
16 mol 294 unq 2 iso 0 dist 9.14005 9.32126 4.76434 15.943 9.33755 13.0844 numMergedOcc 0
17 mol 294 unq 3 iso 0 dist 9.14005 9.38111 10.769 15.943 9.33755 17.4056 numMergedOcc 0
