0 mol 26 unq 0 iso 0 dist 5.58467 9.15677 7.42841 7.12452 6.40556 13.6021 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 5.58467 9.15677 7.42841 6.46053 5.272 10.6139 numMergedOcc 0
2 mol 89 unq 0 iso 0 dist 5.37527 8.89514 10.5385 4.71456 6.54089 13.5823 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 8.43908 6.9538 6.89206 6.24587 8.80424 9.35212 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 8.43908 9.36111 10.0512 6.24587 8.80424 13.7328 numMergedOcc 0
5 mol 110 unq 0 iso 0 dist 9.35378 6.59361 8.6616 10.4311 9.02174 9.83039 numMergedOcc 0
6 mol 127 unq 0 iso 0 dist 6.46753 9.79448 9.75166 7.11155 9.78409 8.09965 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 6.30762 9.64856 5.29246 7.19035 6.77889 11.7668 numMergedOcc 0
8 mol 131 unq 1 iso 0 dist 6.30762 6.38977 8.25445 7.19035 6.77889 12.1672 numMergedOcc 0
9 mol 131 unq 2 iso 0 dist 6.30762 9.69757 11.8349 7.19035 6.77889 13.952 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 7.94258 6.7319 13.548 4.6455 9.32231 10.4712 numMergedOcc 0
11 mol 153 unq 0 iso 0 dist 7.53192 9.79001 7.16014 9.99692 9.6083 15.8837 numMergedOcc 0
12 mol 178 unq 0 iso 0 dist 9.1197 6.01118 5.13245 7.09944 8.71294 5.41229 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.11273 8.08787 7.9704 5.29106 9.26913 12.1539 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 8.87835 7.19917 5.82028 8.78987 8.14413 7.86668 numMergedOcc 0
15 mol 241 unq 0 iso 0 dist 8.10617 8.98617 7.77159 5.07803 7.89536 10.9949 numMergedOcc 0
16 mol 241 unq 1 iso 0 dist 8.10617 6.74552 9.5998 5.07803 7.89536 11.408 numMergedOcc 0
17 mol 265 unq 0 iso 0 dist 9.09556 5.81421 5.56416 10.6585 5.14122 7.83102 numMergedOcc 0
18 mol 282 unq 0 iso 0 dist 9.40138 7.70229 4.58403 5.9433 5.72197 7.34596 numMergedOcc 0
19 mol 282 unq 1 iso 0 dist 9.40138 7.90792 5.04235 5.9433 5.72197 7.12228 numMergedOcc 0
20 mol 294 unq 0 iso 0 dist 5.49473 9.6958 12.2027 4.9798 7.6859 11.5042 numMergedOcc 0
21 mol 294 unq 1 iso 0 dist 5.49473 9.6958 12.2027 6.13274 8.35722 15.5244 numMergedOcc 0
