0 mol 24 unq 0 iso 0 dist 8.10063 9.67926 4.49191 11.7903 8.58581 13.0162 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 9.30432 9.62895 13.0787 7.64564 6.76674 14.7822 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.66461 7.77714 5.82846 13.11 8.66272 6.01454 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 8.81136 6.46118 5.82846 4.99432 8.66272 6.01454 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 9.12873 9.97224 5.23555 12.4426 7.87897 13.052 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 7.67696 8.88983 5.45501 10.1267 8.88417 13.3426 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 7.99359 6.36344 9.13867 10.066 9.55097 15.0661 numMergedOcc 0
7 mol 136 unq 0 iso 0 dist 5.00698 8.7469 12.9876 6.16949 7.90126 12.8607 numMergedOcc 0
8 mol 136 unq 1 iso 0 dist 5.00698 9.89967 8.94322 6.16949 7.90126 11.4244 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 4.95077 9.59193 5.90316 5.60671 6.26222 11.7081 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 8.41614 8.12739 4.81365 9.30712 9.30469 6.03184 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 8.72113 9.26913 4.96821 11.1477 4.47148 9.31525 numMergedOcc 0
12 mol 217 unq 0 iso 0 dist 6.86611 9.62606 6.28311 10.9243 9.94746 6.01666 numMergedOcc 0
13 mol 223 unq 0 iso 0 dist 9.10041 6.33896 11.0723 15.9264 9.03969 19.6411 numMergedOcc 0
14 mol 241 unq 0 iso 0 dist 8.50897 7.89536 5.71803 9.55882 9.27693 12.1981 numMergedOcc 0
15 mol 241 unq 1 iso 0 dist 8.10031 9.744 5.37459 6.51459 9.27693 7.41298 numMergedOcc 0
16 mol 241 unq 2 iso 0 dist 8.10031 7.62827 5.02153 6.51459 9.27693 9.99337 numMergedOcc 0
17 mol 251 unq 0 iso 0 dist 7.73217 5.63943 7.92068 7.37996 8.50339 9.65815 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 9.4961 6.55208 15.1918 12.8512 8.48012 16.5768 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 8.3978 7.17562 15.1918 10.7843 8.48012 16.5768 numMergedOcc 0
