0 mol 33 unq 0 iso 0 dist 5.32407 9.67585 9.3686 6.72942 6.42569 8.32902 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 6.53102 9.67585 8.49894 6.72942 9.13872 8.32902 numMergedOcc 0
2 mol 33 unq 2 iso 0 dist 7.76575 9.67585 5.75951 6.72942 7.27307 8.32902 numMergedOcc 0
3 mol 33 unq 3 iso 0 dist 9.74394 9.67585 3.82391 6.72942 5.73206 8.32902 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 5.24284 6.68114 3.82947 11.3097 8.95571 12.0896 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 7.68259 7.07124 10.6754 10.4572 9.94756 15.7477 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 9.34288 7.40698 4.69809 12.391 7.30652 10.5659 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 9.75708 7.10218 6.7906 10.6655 6.69184 11.4198 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 7.98824 9.28726 6.69911 5.1763 9.33989 6.55112 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 9.42329 9.28726 3.94216 5.1763 8.57953 6.55112 numMergedOcc 0
10 mol 103 unq 0 iso 0 dist 5.7953 5.62245 8.52805 4.71591 8.99759 9.8896 numMergedOcc 0
11 mol 122 unq 0 iso 0 dist 8.3907 6.91978 3.65582 14.6893 9.62551 11.701 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 9.51189 6.04336 9.03587 6.43666 6.36789 8.09915 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 9.51189 9.00537 12.4735 6.43666 6.36789 13.5466 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 8.95136 9.71147 11.9786 10.5621 9.44038 17.2329 numMergedOcc 0
15 mol 205 unq 1 iso 0 dist 8.95136 6.32553 10.0544 10.5621 9.44038 10.4944 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 8.36772 9.00218 6.88396 4.62851 9.72186 12.0582 numMergedOcc 0
17 mol 233 unq 1 iso 0 dist 8.36772 6.0751 6.41724 4.62851 9.72186 10.1279 numMergedOcc 0
18 mol 233 unq 2 iso 0 dist 8.83541 9.00218 8.71119 4.62851 8.39315 12.0582 numMergedOcc 0
19 mol 233 unq 3 iso 0 dist 8.83541 6.0751 10.8172 4.62851 8.39315 10.1279 numMergedOcc 0
20 mol 233 unq 4 iso 0 dist 7.55878 9.00218 3.66075 14.8036 8.01777 10.0877 numMergedOcc 0
21 mol 233 unq 5 iso 0 dist 7.55878 6.0751 3.98113 14.8036 8.01777 11.2355 numMergedOcc 0
22 mol 233 unq 6 iso 0 dist 4.91191 7.69531 3.66075 4.26152 8.01777 10.0877 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 8.31187 8.30771 14.2431 7.73497 7.15878 10.7666 numMergedOcc 0
24 mol 247 unq 0 iso 0 dist 6.35578 8.85175 7.1875 10.9079 9.75065 6.84199 numMergedOcc 0
25 mol 285 unq 0 iso 0 dist 5.77107 7.12723 8.02755 6.49869 7.38536 11.6344 numMergedOcc 0
