0 mol 24 unq 0 iso 0 dist 6.86014 6.60423 6.00575 7.95042 5.69214 4.47891 8.66248 7.49157 9.41655 12.089 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.86014 6.60423 6.00575 7.95042 5.69214 4.47891 6.73521 7.73794 6.803 10.4905 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 8.86116 6.60423 5.97304 7.95042 5.11636 4.47891 8.66248 14.9512 9.41655 12.089 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 8.86116 6.60423 5.97304 7.95042 5.11636 4.47891 6.73521 12.1131 6.803 10.4905 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 5.54419 4.93188 4.33963 6.6219 4.82629 8.32592 13.5399 13.6588 9.65174 17.7547 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 5.54419 4.93188 4.33963 5.68215 10.1698 8.10397 13.5399 13.6588 9.65174 13.302 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 7.36323 9.24958 4.33963 8.87744 6.28159 7.55689 15.0923 13.6588 9.65174 13.4865 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 7.36323 9.24958 4.33963 7.27472 5.50396 5.11135 15.0923 13.6588 9.65174 10.3921 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 5.73819 8.44903 5.48048 6.66407 5.07458 4.69849 9.80379 11.4251 9.82307 12.2699 numMergedOcc 0
9 mol 60 unq 0 iso 0 dist 8.90863 8.82176 13.0114 9.95132 8.27828 12.9345 7.1082 14.9987 6.46718 15.0548 numMergedOcc 0
10 mol 60 unq 1 iso 0 dist 8.90863 8.82176 13.0114 7.48086 7.80499 5.71764 7.1082 14.9987 6.46718 9.98904 numMergedOcc 0
11 mol 60 unq 2 iso 0 dist 8.7531 7.55695 9.62257 8.4312 8.62476 5.71764 5.42423 12.663 6.46718 9.98904 numMergedOcc 0
12 mol 112 unq 0 iso 0 dist 7.71338 6.47042 10.0814 8.47988 6.95317 8.90959 4.69658 6.87434 9.34689 5.92828 numMergedOcc 0
13 mol 112 unq 1 iso 0 dist 7.71338 6.47042 10.0814 8.0427 7.57713 4.4941 4.69658 6.87434 9.34689 9.1247 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 8.73993 8.56342 4.91132 7.64052 9.68677 6.29394 13.2169 10.1864 7.62197 12.3503 numMergedOcc 0
15 mol 119 unq 1 iso 0 dist 9.87172 7.99857 7.61939 6.99446 6.20019 6.29394 10.4816 10.3523 7.62197 12.3503 numMergedOcc 0
16 mol 143 unq 0 iso 0 dist 5.99315 8.41611 12.7056 7.36975 13.1926 9.05786 6.75249 8.64905 7.22 11.7801 numMergedOcc 0
17 mol 143 unq 1 iso 0 dist 5.99315 8.41611 12.7056 5.40637 7.39837 6.16103 6.75249 8.64905 7.22 6.60366 numMergedOcc 0
18 mol 152 unq 0 iso 0 dist 5.87555 8.28642 5.70788 6.70693 4.94983 4.71678 4.68615 6.79114 7.34557 8.60651 numMergedOcc 0
19 mol 152 unq 1 iso 0 dist 8.56324 9.77552 9.35627 6.59889 5.39112 4.71678 10.6994 10.338 7.34557 8.60651 numMergedOcc 0
20 mol 152 unq 2 iso 0 dist 8.56324 9.77552 9.35627 8.9192 4.84714 7.11377 10.6994 10.338 7.34557 11.544 numMergedOcc 0
21 mol 152 unq 3 iso 0 dist 6.70283 8.28642 9.35627 6.70693 5.39112 4.71678 4.68615 10.338 7.34557 8.60651 numMergedOcc 0
22 mol 152 unq 4 iso 0 dist 8.67331 8.28642 11.2078 6.70693 9.67475 4.71678 4.68615 10.3706 7.34557 8.60651 numMergedOcc 0
23 mol 175 unq 0 iso 0 dist 9.29945 7.35824 12.5754 9.63417 11.0361 5.68406 10.7092 18.0216 6.90373 12.4873 numMergedOcc 0
24 mol 252 unq 0 iso 0 dist 7.19638 6.86945 5.25252 7.15764 7.40852 4.34126 9.93981 12.9602 8.38453 9.81261 numMergedOcc 0
25 mol 264 unq 0 iso 0 dist 9.17653 6.14323 13.0621 8.29262 10.7813 5.82131 10.6043 18.9559 8.78525 12.2745 numMergedOcc 0
