0 mol 10 unq 0 iso 0 dist 7.51287 5.50657 6.20404 8.2927 7.21183 5.64721 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 4.85969 8.00085 6.91627 6.13614 8.99098 12.7938 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 9.12848 4.84965 8.2056 10.5553 8.24798 10.2716 numMergedOcc 0
3 mol 18 unq 1 iso 0 dist 9.12848 4.84965 8.2056 12.9137 8.02079 10.3407 numMergedOcc 0
4 mol 38 unq 0 iso 0 dist 8.19347 10.1065 9.49676 4.26938 7.88321 12.2047 numMergedOcc 0
5 mol 44 unq 0 iso 0 dist 7.73902 5.33887 7.98624 4.83564 6.14602 7.74211 numMergedOcc 0
6 mol 44 unq 1 iso 0 dist 7.73902 5.33887 7.98624 4.29306 7.41011 6.30655 numMergedOcc 0
7 mol 81 unq 0 iso 0 dist 9.12919 7.67847 8.68497 9.01152 7.41802 6.61128 numMergedOcc 0
8 mol 93 unq 0 iso 0 dist 4.45006 5.25364 8.52947 6.69378 8.55124 8.7353 numMergedOcc 0
9 mol 93 unq 1 iso 0 dist 4.45006 7.1496 8.84466 6.69378 8.55124 13.0411 numMergedOcc 0
10 mol 113 unq 0 iso 0 dist 7.92498 6.31058 8.28452 9.25139 9.15172 10.03 numMergedOcc 0
11 mol 113 unq 1 iso 0 dist 7.92498 11.6347 8.44004 9.25139 9.15172 3.97916 numMergedOcc 0
12 mol 128 unq 0 iso 0 dist 7.4738 10.7154 8.98367 13.9893 9.74232 12.3372 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 6.46871 10.9673 7.76856 12.0398 9.9855 7.11016 numMergedOcc 0
14 mol 235 unq 0 iso 0 dist 9.48967 12.6185 9.61454 16.3696 8.52954 7.46421 numMergedOcc 0
15 mol 235 unq 1 iso 0 dist 6.43002 7.84608 9.61454 11.7071 8.52954 7.46421 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 5.41373 5.23356 8.71686 6.12374 6.75599 4.93374 numMergedOcc 0
17 mol 247 unq 0 iso 0 dist 6.35578 6.74468 9.79737 6.14573 7.85081 12.8215 numMergedOcc 0
18 mol 247 unq 1 iso 0 dist 6.35578 9.39272 8.34155 6.14573 7.85081 11.7575 numMergedOcc 0
19 mol 247 unq 2 iso 0 dist 6.35578 10.3476 8.30945 6.14573 7.85081 9.93257 numMergedOcc 0
20 mol 256 unq 0 iso 0 dist 9.59101 12.4486 9.36652 7.51657 8.88264 15.6445 numMergedOcc 0
21 mol 256 unq 1 iso 0 dist 9.59101 8.11848 7.54613 7.51657 8.88264 11.974 numMergedOcc 0
22 mol 271 unq 0 iso 0 dist 9.27556 7.30325 8.74168 5.22029 8.54162 8.8277 numMergedOcc 0
