0 mol 28 unq 0 iso 0 dist 8.60461 8.06843 4.15828 12.0732 5.65894 8.02162 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 8.60461 8.06843 4.15828 8.53816 6.83794 9.97227 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 9.5209 5.78231 4.84198 16.3014 8.34024 13.0026 numMergedOcc 0
3 mol 32 unq 1 iso 0 dist 8.9881 9.41538 4.84198 13.1825 8.34024 13.0026 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 9.4815 7.68019 9.78639 9.59415 8.82122 11.2523 numMergedOcc 0
5 mol 90 unq 0 iso 0 dist 6.11881 8.17454 9.69029 6.18091 9.43446 14.3223 numMergedOcc 0
6 mol 110 unq 0 iso 0 dist 9.58164 7.59747 4.28852 6.69022 9.13723 9.45247 numMergedOcc 0
7 mol 111 unq 0 iso 0 dist 9.02541 6.33923 11.4065 6.48732 4.9128 11.3324 numMergedOcc 0
8 mol 111 unq 1 iso 0 dist 9.02541 9.9801 10.4026 6.48732 4.9128 12.6356 numMergedOcc 0
9 mol 147 unq 0 iso 0 dist 4.48898 8.94352 6.60281 4.93601 5.96285 8.62135 numMergedOcc 0
10 mol 147 unq 1 iso 0 dist 7.06711 7.50372 9.88741 6.64765 5.96285 12.216 numMergedOcc 0
11 mol 193 unq 0 iso 0 dist 9.06161 7.73964 13.7209 6.05626 7.20955 11.7397 numMergedOcc 0
12 mol 260 unq 0 iso 0 dist 9.25515 9.11501 9.38032 7.2156 5.9721 8.43724 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 8.91185 9.2684 11.6746 10.3186 9.19928 18.188 numMergedOcc 0
