0 mol 44 unq 0 iso 0 dist 7.16036 4.61354 7.78905 4.52881 6.07691 7.85573 numMergedOcc 0
1 mol 44 unq 1 iso 0 dist 7.16036 6.03595 9.44909 4.52881 6.07691 6.21423 numMergedOcc 0
2 mol 51 unq 0 iso 0 dist 7.7625 9.10817 7.12423 11.3631 5.27155 6.50216 numMergedOcc 0
3 mol 51 unq 1 iso 0 dist 7.7625 9.10817 7.12423 18.9198 14.6972 9.83073 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 6.85083 8.5275 7.7978 10.7972 6.34264 5.70814 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 6.85083 10.3175 9.55751 10.7972 6.34264 5.58384 numMergedOcc 0
6 mol 61 unq 0 iso 0 dist 9.99643 3.60123 8.46556 10.0527 11.5608 9.67403 numMergedOcc 0
7 mol 86 unq 0 iso 0 dist 7.26032 4.4104 8.88225 9.93274 10.9597 7.91639 numMergedOcc 0
8 mol 86 unq 1 iso 0 dist 5.49793 9.86291 8.88225 15.0152 10.9597 7.91639 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.59784 9.25954 5.63005 13.5972 12.1168 9.44788 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 6.22696 6.19883 8.3337 13.0169 11.713 8.47576 numMergedOcc 0
11 mol 197 unq 1 iso 0 dist 6.22696 6.19883 8.3337 10.4673 8.69245 5.79753 numMergedOcc 0
12 mol 197 unq 2 iso 0 dist 8.12158 6.19883 5.41292 13.0169 5.2542 8.47576 numMergedOcc 0
13 mol 197 unq 3 iso 0 dist 8.12158 6.19883 5.41292 10.4673 4.6678 5.79753 numMergedOcc 0
14 mol 219 unq 0 iso 0 dist 9.91592 7.14751 4.87446 12.9312 10.9246 9.52151 numMergedOcc 0
15 mol 219 unq 1 iso 0 dist 9.91592 7.14751 4.87446 13.8835 10.1098 8.62654 numMergedOcc 0
16 mol 241 unq 0 iso 0 dist 8.62971 5.69491 9.18476 8.99792 4.86437 8.15897 numMergedOcc 0
17 mol 249 unq 0 iso 0 dist 6.42827 7.26569 6.37672 9.63838 9.82483 7.279 numMergedOcc 0
18 mol 249 unq 1 iso 0 dist 6.42827 6.09915 8.94023 9.63838 9.82483 8.43448 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 6.49599 11.5386 8.06771 10.3275 5.71237 5.98006 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 5.81421 4.86861 7.04833 9.09556 5.56416 6.98812 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 8.27977 4.0145 7.74162 8.85653 6.03718 9.71653 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 6.8133 9.57206 5.75596 17.2665 13.9754 8.92332 numMergedOcc 0
