0 mol 12 unq 0 iso 0 dist 4.85969 9.32718 6.28592 6.13614 8.99098 11.8259 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 9.12848 8.25905 4.49033 10.5553 8.24798 8.95294 numMergedOcc 0
2 mol 18 unq 1 iso 0 dist 9.12848 8.25905 4.49033 12.9137 8.02079 7.19022 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 9.12062 5.73257 10.7494 6.00825 5.68877 9.14069 numMergedOcc 0
4 mol 141 unq 0 iso 0 dist 8.47476 9.55297 5.65619 6.35915 8.53875 12.0217 numMergedOcc 0
5 mol 141 unq 1 iso 0 dist 8.47476 7.447 14.1869 6.35915 8.53875 11.3409 numMergedOcc 0
6 mol 141 unq 2 iso 0 dist 8.47476 6.59782 8.66026 6.35915 8.53875 8.12409 numMergedOcc 0
7 mol 154 unq 0 iso 0 dist 9.71025 5.81632 6.28784 9.05948 6.59749 9.39643 numMergedOcc 0
8 mol 194 unq 0 iso 0 dist 8.40769 9.20864 10.2713 8.30307 9.64864 10.5215 numMergedOcc 0
9 mol 235 unq 0 iso 0 dist 9.48967 6.43838 15.6099 16.3696 8.52954 21.9339 numMergedOcc 0
10 mol 235 unq 1 iso 0 dist 9.48967 9.24964 4.28284 16.3696 8.52954 10.0749 numMergedOcc 0
11 mol 235 unq 2 iso 0 dist 6.43002 5.71896 4.28284 11.7071 8.52954 10.0749 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 5.41373 6.89216 5.98329 6.12374 6.75599 5.72415 numMergedOcc 0
13 mol 247 unq 0 iso 0 dist 6.35578 6.34304 4.32191 6.14573 7.85081 9.88695 numMergedOcc 0
14 mol 277 unq 0 iso 0 dist 6.58667 9.28545 13.5948 10.4217 9.027 19.0283 numMergedOcc 0
15 mol 277 unq 1 iso 0 dist 6.01542 9.28545 4.29127 5.57184 7.91992 8.62043 numMergedOcc 0
