0 mol 73 unq 0 iso 0 dist 8.07638 7.37476 12.3943 6.28936 13.118 5.92936 4.49648 8.73093 7.48556 4.97519 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 8.07638 7.37476 12.3943 6.28936 13.118 5.92936 4.50556 9.1622 9.47045 9.95663 numMergedOcc 0
2 mol 73 unq 2 iso 0 dist 8.07638 7.37476 12.3943 6.28936 13.118 5.92936 4.53367 12.2532 8.68218 6.87319 numMergedOcc 0
3 mol 73 unq 3 iso 0 dist 6.79787 7.37476 9.57143 6.28936 11.5539 5.92936 4.49648 8.02104 7.48556 4.97519 numMergedOcc 0
4 mol 73 unq 4 iso 0 dist 6.79787 7.37476 9.57143 6.28936 11.5539 5.92936 4.50556 7.59013 9.47045 9.95663 numMergedOcc 0
5 mol 73 unq 5 iso 0 dist 6.79787 7.37476 9.57143 6.28936 11.5539 5.92936 4.53367 10.8016 8.68218 6.87319 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 9.0101 7.52544 7.7047 6.1691 12.1652 7.02854 4.77004 7.41861 5.73235 5.22567 numMergedOcc 0
7 mol 90 unq 0 iso 0 dist 8.91055 8.60438 4.59148 4.77259 9.28585 6.6146 9.63545 13.0735 9.06641 5.12529 numMergedOcc 0
8 mol 91 unq 0 iso 0 dist 8.94991 5.22576 6.16048 5.05933 10.8851 5.78962 6.39764 9.63646 8.91354 7.47242 numMergedOcc 0
9 mol 204 unq 0 iso 0 dist 9.70166 9.12896 5.55359 8.40223 7.19213 7.00683 13.4281 13.5496 9.52029 8.61406 numMergedOcc 0
10 mol 229 unq 0 iso 0 dist 8.17234 5.95601 5.17118 5.01153 12.3614 8.36396 4.47956 9.98251 7.48693 5.52342 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 5.40329 7.73969 6.0905 10.4934 12.3123 9.13126 11.1044 10.752 4.71683 8.3795 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 7.45786 8.4319 12.8324 6.72716 10.5771 9.59937 10.3585 14.8278 7.58554 5.94643 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 9.44043 9.27225 9.26732 4.49451 10.3095 8.97411 11.1283 5.9223 8.58092 13.2474 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 9.477 9.51286 5.54798 18.6043 11.7492 9.77392 8.13583 12.9059 9.0836 16.492 numMergedOcc 0
15 mol 266 unq 1 iso 0 dist 9.477 9.51286 5.54798 18.6043 11.7492 9.77392 4.80695 11.907 9.62494 18.9489 numMergedOcc 0
