0 mol 7 unq 0 iso 0 dist 8.75465 8.00249 4.80709 9.69313 8.15894 11.7902 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.75465 8.00249 4.80709 5.28778 8.45544 10.3845 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.48944 9.04448 11.9756 8.65417 7.96195 16.4932 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.48944 6.6834 13.4516 8.65417 7.96195 11.96 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 6.6834 8.48944 13.4516 11.8013 8.24948 13.5399 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 6.6834 9.04448 10.7501 11.8013 8.24948 13.0098 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 7.49235 7.19431 5.21654 7.46124 7.8435 5.99269 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 7.19431 7.49235 5.21654 7.46124 5.99269 7.8435 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 5.91797 6.37954 6.70343 9.74702 6.83746 11.6715 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 5.91797 6.37954 6.70343 10.213 9.14707 9.18457 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 6.37954 5.91797 6.70343 10.7165 8.75597 12.2279 numMergedOcc 0
11 mol 98 unq 3 iso 0 dist 6.37954 5.91797 6.70343 10.213 9.18457 9.14707 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 7.76446 6.14652 5.83782 9.75179 6.99345 5.11043 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 6.14652 7.76446 5.83782 9.75179 5.11043 6.99345 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 9.4275 9.83462 3.55572 12.369 7.1069 10.6459 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 8.95209 9.16579 9.58899 8.49599 6.07389 11.8733 numMergedOcc 0
16 mol 188 unq 0 iso 0 dist 8.01604 9.07006 3.68927 9.09717 7.79115 11.1486 numMergedOcc 0
17 mol 188 unq 1 iso 0 dist 7.03264 6.32826 3.68927 10.3393 7.79115 11.1486 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 6.32553 9.71147 8.01847 9.91251 7.53395 15.5347 numMergedOcc 0
19 mol 260 unq 0 iso 0 dist 6.19564 6.79386 3.64495 9.39438 9.50634 12.3456 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 9.88198 9.88022 19.0111 11.9209 5.81528 21.6009 numMergedOcc 0
21 mol 279 unq 1 iso 0 dist 9.88198 7.26637 13.095 11.9209 5.81528 15.4764 numMergedOcc 0
