0 mol 45 unq 0 iso 0 dist 7.84098 6.4953 6.34173 10.4102 5.24762 7.06308 numMergedOcc 0
1 mol 45 unq 1 iso 0 dist 7.84098 6.4953 6.34173 8.99855 5.101 9.43442 numMergedOcc 0
2 mol 45 unq 2 iso 0 dist 8.99855 6.4953 9.43442 10.4102 5.48601 7.06308 numMergedOcc 0
3 mol 45 unq 3 iso 0 dist 8.99855 6.4953 9.43442 7.84098 5.101 6.34173 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 7.10826 14.7989 8.70133 14.3881 7.4697 5.64598 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 7.10826 14.7989 8.70133 10.8452 5.4148 4.65521 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 9.21974 11.1821 7.22293 11.9953 6.9948 9.47876 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 7.92708 11.5994 6.58204 5.1385 5.88134 7.75343 numMergedOcc 0
8 mol 100 unq 1 iso 0 dist 5.1385 11.5994 7.75343 7.92708 5.88134 6.58204 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 9.46144 7.04769 8.71128 9.66471 5.59517 7.52743 numMergedOcc 0
10 mol 114 unq 1 iso 0 dist 9.66471 7.04769 7.52743 9.46144 5.59517 8.71128 numMergedOcc 0
11 mol 117 unq 0 iso 0 dist 8.08241 10.0618 6.62561 13.4159 7.22206 7.63616 numMergedOcc 0
12 mol 131 unq 0 iso 0 dist 7.30166 5.2907 8.6243 9.82508 6.63273 6.91348 numMergedOcc 0
13 mol 131 unq 1 iso 0 dist 9.82508 5.2907 6.91348 7.30166 6.63273 8.6243 numMergedOcc 0
14 mol 132 unq 0 iso 0 dist 7.41216 4.18391 6.03703 10.2901 4.35917 7.61505 numMergedOcc 0
15 mol 213 unq 0 iso 0 dist 8.44476 13.4229 9.59129 16.0308 13.7995 8.45368 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 8.58719 4.39953 7.07392 12.6064 4.96364 9.62952 numMergedOcc 0
17 mol 232 unq 1 iso 0 dist 9.64301 4.45663 7.07392 11.8256 4.96364 9.62952 numMergedOcc 0
18 mol 240 unq 0 iso 0 dist 7.46026 4.21987 6.15305 9.99977 4.28414 7.03489 numMergedOcc 0
