0 mol 20 unq 0 iso 0 dist 4.15066 6.4074 8.3037 5.31696 9.36641 8.19319 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.83402 5.70349 4.11406 5.03904 8.27137 7.21175 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 7.19959 4.82824 4.77769 7.34653 10.2763 8.31317 numMergedOcc 0
3 mol 81 unq 0 iso 0 dist 6.03428 9.78763 9.95888 14.5186 16.4194 7.1229 numMergedOcc 0
4 mol 81 unq 1 iso 0 dist 6.03428 9.78763 9.95888 8.57407 13.4084 9.36388 numMergedOcc 0
5 mol 81 unq 2 iso 0 dist 6.03428 9.61137 11.1271 8.57407 13.4084 9.08333 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 9.04398 5.6738 11.3166 7.16792 15.5351 6.41507 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 9.04398 5.6738 11.3166 7.6316 15.8205 6.03035 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 8.22824 7.77458 14.5158 3.64555 10.6236 5.35285 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 8.22824 7.77458 14.5158 4.78701 8.78303 6.71328 numMergedOcc 0
10 mol 146 unq 0 iso 0 dist 9.5348 9.58114 12.333 8.19476 6.93154 6.97799 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 8.05227 8.49016 13.4823 4.26432 6.0033 8.53485 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 9.14778 9.46077 6.01175 7.46055 9.99149 6.23614 numMergedOcc 0
13 mol 229 unq 0 iso 0 dist 8.17234 5.82844 10.8457 7.5737 12.3517 8.34954 numMergedOcc 0
14 mol 229 unq 1 iso 0 dist 8.17234 5.82844 10.8457 4.39666 9.61759 9.27328 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 7.45786 8.55105 6.81743 3.73109 10.005 8.44521 numMergedOcc 0
16 mol 270 unq 0 iso 0 dist 6.62637 7.7975 6.1174 5.44817 5.98384 6.30711 numMergedOcc 0
