0 mol 54 unq 0 iso 0 dist 8.34361 4.38047 5.01159 6.76462 10.5929 6.14538 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 7.49861 6.23138 6.11938 4.96726 11.8671 9.97159 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 6.2165 6.23138 4.43442 4.96726 10.9973 9.97159 numMergedOcc 0
3 mol 113 unq 0 iso 0 dist 9.15172 5.37302 11.6513 14.0364 18.281 9.66219 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 8.27253 8.75431 7.21894 10.7421 7.85527 8.99399 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 9.66828 9.86988 5.85167 7.59962 6.23966 7.58957 numMergedOcc 0
6 mol 163 unq 0 iso 0 dist 6.96837 9.62943 8.83719 4.12904 10.0272 9.07943 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 9.99964 5.97968 7.23046 9.09989 14.2552 8.90963 numMergedOcc 0
8 mol 181 unq 1 iso 0 dist 6.93144 8.50382 7.23046 12.4243 14.2552 8.90963 numMergedOcc 0
9 mol 181 unq 2 iso 0 dist 7.04782 9.07527 14.9846 9.32503 15.3017 5.9176 numMergedOcc 0
10 mol 232 unq 0 iso 0 dist 8.21479 7.83422 8.15893 9.60401 12.5644 9.05071 numMergedOcc 0
11 mol 258 unq 0 iso 0 dist 6.41167 8.63176 9.76914 8.27707 10.2557 9.63959 numMergedOcc 0
12 mol 258 unq 1 iso 0 dist 6.41167 8.63176 9.76914 13.5559 18.0061 9.96262 numMergedOcc 0
13 mol 258 unq 2 iso 0 dist 6.41167 8.63176 9.76914 6.48867 10.7821 7.21311 numMergedOcc 0
14 mol 273 unq 0 iso 0 dist 5.75335 6.38341 5.63899 5.75973 10.3979 8.83865 numMergedOcc 0
15 mol 273 unq 1 iso 0 dist 5.75335 6.38341 5.63899 9.40198 13.3402 9.18157 numMergedOcc 0
16 mol 273 unq 2 iso 0 dist 8.76527 6.38341 11.3048 5.75973 11.4082 8.83865 numMergedOcc 0
17 mol 273 unq 3 iso 0 dist 8.76527 6.38341 11.3048 9.40198 16.4065 9.18157 numMergedOcc 0
18 mol 292 unq 0 iso 0 dist 9.86767 6.60049 6.28133 6.94727 15.3076 9.88863 numMergedOcc 0
