0 mol 20 unq 0 iso 0 dist 4.90613 9.88827 8.88148 10.452 7.89835 11.9886 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 4.90613 9.88827 8.88148 13.3417 9.94205 14.2098 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 4.90613 9.88827 8.88148 12.4239 9.08453 16.063 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 4.90613 6.30355 6.83357 10.452 7.89835 10.3493 numMergedOcc 0
4 mol 20 unq 4 iso 0 dist 4.90613 6.30355 6.83357 13.3417 9.94205 13.242 numMergedOcc 0
5 mol 20 unq 5 iso 0 dist 4.90613 6.30355 6.83357 12.4239 9.08453 14.4544 numMergedOcc 0
6 mol 20 unq 6 iso 0 dist 4.90613 6.02975 4.71011 10.452 7.89835 6.29237 numMergedOcc 0
7 mol 20 unq 7 iso 0 dist 4.90613 6.02975 4.71011 13.3417 9.94205 9.24286 numMergedOcc 0
8 mol 20 unq 8 iso 0 dist 4.90613 6.02975 4.71011 12.4239 9.08453 10.5059 numMergedOcc 0
9 mol 24 unq 0 iso 0 dist 6.32779 9.04898 4.39474 5.15319 6.77987 6.55728 numMergedOcc 0
10 mol 24 unq 1 iso 0 dist 9.33902 6.03041 11.5035 6.01288 6.74914 10.7722 numMergedOcc 0
11 mol 24 unq 2 iso 0 dist 9.33902 7.47051 11.3998 6.01288 6.74914 10.6046 numMergedOcc 0
12 mol 30 unq 0 iso 0 dist 9.50224 8.62106 10.116 9.10395 9.67564 13.4839 numMergedOcc 0
13 mol 63 unq 0 iso 0 dist 9.22609 8.38463 7.1113 3.79852 8.53833 6.8848 numMergedOcc 0
14 mol 91 unq 0 iso 0 dist 9.52936 9.01327 11.0079 10.5022 6.64714 11.042 numMergedOcc 0
15 mol 95 unq 0 iso 0 dist 6.4081 7.27074 3.8075 9.97278 8.0675 11.3191 numMergedOcc 0
16 mol 132 unq 0 iso 0 dist 8.78382 8.96089 4.01392 8.85207 9.15119 11.1368 numMergedOcc 0
17 mol 182 unq 0 iso 0 dist 7.37431 6.17569 7.45392 3.85894 7.75041 9.5835 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 5.52744 9.44052 5.81649 11.7817 9.22792 14.105 numMergedOcc 0
19 mol 186 unq 1 iso 0 dist 5.52744 9.44052 5.81649 8.23538 7.85696 13.6402 numMergedOcc 0
20 mol 186 unq 2 iso 0 dist 5.52744 9.44052 5.81649 5.74741 5.00402 10.6254 numMergedOcc 0
21 mol 186 unq 3 iso 0 dist 5.52744 9.44052 5.81649 3.88002 6.17773 11.2664 numMergedOcc 0
22 mol 196 unq 0 iso 0 dist 5.6789 8.47894 6.92142 6.95386 9.03626 10.1178 numMergedOcc 0
23 mol 278 unq 0 iso 0 dist 6.08019 9.00962 5.4029 7.33993 9.90216 14.2537 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 5.06731 8.0077 6.80232 11.2805 9.98518 9.62446 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 5.06731 8.0077 6.80232 11.2805 9.98518 9.62446 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 5.06731 8.0077 6.80232 11.2805 9.98518 9.62446 numMergedOcc 0
