0 mol 63 unq 0 iso 0 dist 8.23376 15.4938 9.84668 4.33177 6.65465 11.8129 numMergedOcc 0
1 mol 65 unq 0 iso 0 dist 8.09807 9.72979 9.9997 13.1464 9.75927 6.65154 numMergedOcc 0
2 mol 78 unq 0 iso 0 dist 9.80802 9.23555 7.80757 5.50093 9.45835 5.53214 numMergedOcc 0
3 mol 78 unq 1 iso 0 dist 9.80802 11.0548 9.2835 5.50093 9.45835 14.7492 numMergedOcc 0
4 mol 78 unq 2 iso 0 dist 9.80802 8.34252 5.02591 5.50093 9.45835 10.6915 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 9.46702 11.4552 7.47827 16.3403 8.00525 7.15993 numMergedOcc 0
6 mol 91 unq 1 iso 0 dist 8.87781 11.5667 7.47827 15.6892 8.00525 7.15993 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 9.02255 6.67738 6.05043 15.8741 9.17862 11.1228 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 9.02255 6.67738 6.05043 6.29336 8.27456 6.99612 numMergedOcc 0
9 mol 95 unq 2 iso 0 dist 7.89797 5.79921 6.05043 14.9945 9.17862 11.1228 numMergedOcc 0
10 mol 95 unq 3 iso 0 dist 7.89797 5.79921 6.05043 12.0676 8.27456 6.99612 numMergedOcc 0
11 mol 122 unq 0 iso 0 dist 5.94669 6.48966 5.09114 6.7319 8.054 11.2576 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 6.94119 12.1966 8.50904 5.5454 7.94593 9.52671 numMergedOcc 0
13 mol 196 unq 0 iso 0 dist 9.99721 5.73826 6.60651 12.8142 7.84536 10.2953 numMergedOcc 0
14 mol 196 unq 1 iso 0 dist 9.99721 5.73826 6.60651 15.2652 7.07723 11.554 numMergedOcc 0
15 mol 196 unq 2 iso 0 dist 9.99721 5.73826 6.60651 11.8789 6.40064 6.29554 numMergedOcc 0
16 mol 210 unq 0 iso 0 dist 7.08106 6.82955 7.19917 8.02375 7.86668 8.78987 numMergedOcc 0
17 mol 222 unq 0 iso 0 dist 9.76857 14.4497 8.92185 9.65168 9.88432 8.0584 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 7.84754 11.2513 5.76077 11.4039 9.86979 12.8509 numMergedOcc 0
19 mol 253 unq 1 iso 0 dist 7.84754 12.6702 7.0247 11.4039 9.86979 11.3218 numMergedOcc 0
20 mol 253 unq 2 iso 0 dist 6.71362 9.33433 5.76077 6.20788 9.86979 12.8509 numMergedOcc 0
21 mol 253 unq 3 iso 0 dist 6.71362 11.5994 7.0247 6.20788 9.86979 11.3218 numMergedOcc 0
22 mol 271 unq 0 iso 0 dist 9.51133 10.2325 9.04738 13.507 7.06108 7.75956 numMergedOcc 0
