0 mol 66 unq 0 iso 0 dist 8.46077 6.04626 9.28525 11.1962 6.86331 8.95789 numMergedOcc 0
1 mol 66 unq 1 iso 0 dist 5.45305 6.04626 8.55807 11.1962 9.37607 8.95789 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 5.73003 10.9008 9.00799 11.6864 7.15588 5.78962 numMergedOcc 0
3 mol 91 unq 1 iso 0 dist 5.21227 14.1047 9.00799 11.953 7.15588 5.78962 numMergedOcc 0
4 mol 123 unq 0 iso 0 dist 7.27898 9.39674 8.74958 17.6628 12.8839 9.86842 numMergedOcc 0
5 mol 162 unq 0 iso 0 dist 5.96638 13.7363 9.98649 12.974 10.8238 8.954 numMergedOcc 0
6 mol 165 unq 0 iso 0 dist 9.14728 7.23314 4.46402 13.5511 11.4693 9.59989 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 8.22461 11.3935 7.62128 20.4306 14.8895 9.08767 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 8.16081 4.36623 8.01243 7.03223 5.72234 7.35148 numMergedOcc 0
9 mol 224 unq 0 iso 0 dist 8.26636 9.41461 9.55911 13.2281 9.19415 6.6537 numMergedOcc 0
10 mol 224 unq 1 iso 0 dist 8.26636 9.41461 9.55911 7.73616 5.32839 9.08719 numMergedOcc 0
11 mol 224 unq 2 iso 0 dist 7.02669 6.0185 5.74939 7.73616 3.8619 5.97988 numMergedOcc 0
12 mol 224 unq 3 iso 0 dist 7.02669 6.0185 5.74939 11.8883 5.30197 9.37276 numMergedOcc 0
13 mol 283 unq 0 iso 0 dist 9.2825 12.7769 9.83528 13.6876 10.9468 7.88405 numMergedOcc 0
14 mol 283 unq 1 iso 0 dist 5.8676 10.8956 9.83528 13.511 10.9468 7.88405 numMergedOcc 0
15 mol 294 unq 0 iso 0 dist 6.81999 3.95468 8.19745 6.075 10.1933 8.60441 numMergedOcc 0
16 mol 294 unq 1 iso 0 dist 6.81999 3.95468 8.19745 5.27696 6.63396 6.97558 numMergedOcc 0
