0 mol 24 unq 0 iso 0 dist 6.32779 9.04898 4.39474 9.74777 6.09311 8.31805 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.94728 6.03041 10.5428 5.11382 3.94196 7.19357 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 6.94728 7.47051 3.68354 5.11382 3.94196 6.25444 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 9.33902 6.03041 11.5035 5.11382 13.466 7.19357 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 9.33902 7.47051 11.3998 5.11382 13.466 6.25444 numMergedOcc 0
5 mol 81 unq 0 iso 0 dist 7.91009 5.62329 9.30857 4.95504 3.3881 7.01382 numMergedOcc 0
6 mol 81 unq 1 iso 0 dist 4.39121 5.62329 5.50121 4.95504 3.93741 7.01382 numMergedOcc 0
7 mol 90 unq 0 iso 0 dist 7.38568 9.52334 4.76214 6.02596 4.66066 8.97966 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 8.56629 9.42805 4.62676 7.65919 4.31929 6.03116 numMergedOcc 0
9 mol 116 unq 1 iso 0 dist 8.56629 9.42805 4.62676 8.55413 11.987 9.45081 numMergedOcc 0
10 mol 116 unq 2 iso 0 dist 7.56091 9.42805 4.48612 7.65919 3.39035 6.03116 numMergedOcc 0
11 mol 116 unq 3 iso 0 dist 7.56091 9.42805 4.48612 8.55413 6.88393 9.45081 numMergedOcc 0
12 mol 124 unq 0 iso 0 dist 7.24083 5.03702 8.83242 9.01881 11.7364 4.95526 numMergedOcc 0
13 mol 176 unq 0 iso 0 dist 6.21825 8.95295 9.30856 4.67031 3.71345 6.22252 numMergedOcc 0
14 mol 176 unq 1 iso 0 dist 6.21825 8.95295 9.30856 6.20326 6.55919 3.54036 numMergedOcc 0
15 mol 176 unq 2 iso 0 dist 6.21825 8.95295 9.30856 8.98043 8.25138 9.26997 numMergedOcc 0
16 mol 176 unq 3 iso 0 dist 6.21825 8.95295 9.30856 6.8243 7.10617 4.96592 numMergedOcc 0
17 mol 176 unq 4 iso 0 dist 6.21825 8.95295 9.30856 8.90797 10.5042 5.05388 numMergedOcc 0
18 mol 182 unq 0 iso 0 dist 7.37431 6.17569 7.45392 8.54982 4.26532 5.23001 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 5.52744 9.44052 5.81649 7.00382 8.73397 9.68366 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 9.64578 8.00415 10.9092 7.45508 9.1722 5.98994 numMergedOcc 0
21 mol 239 unq 1 iso 0 dist 9.64578 8.00415 10.9092 5.79883 11.457 11.6074 numMergedOcc 0
22 mol 239 unq 2 iso 0 dist 7.02833 8.00415 7.3483 7.45508 11.2097 5.98994 numMergedOcc 0
23 mol 239 unq 3 iso 0 dist 7.02833 8.00415 7.3483 5.79883 6.10489 11.6074 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 7.81282 9.00962 5.01656 7.73107 7.14333 3.39646 numMergedOcc 0
25 mol 278 unq 1 iso 0 dist 6.08019 9.00962 5.4029 7.73107 5.40345 3.39646 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 5.06731 8.0077 6.80232 6.05363 3.76412 3.39991 numMergedOcc 0
27 mol 288 unq 0 iso 0 dist 5.06731 8.0077 6.80232 6.05363 3.76412 3.39991 numMergedOcc 0
28 mol 289 unq 0 iso 0 dist 5.06731 8.0077 6.80232 6.05363 3.76412 3.39991 numMergedOcc 0
