0 mol 38 unq 0 iso 0 dist 7.26639 10.028 7.00717 10.7047 3.50961 8.50003 numMergedOcc 0
1 mol 72 unq 0 iso 0 dist 9.55118 16.024 8.80645 13.641 4.86472 9.25711 numMergedOcc 0
2 mol 72 unq 1 iso 0 dist 9.55118 16.024 8.80645 12.111 4.85556 8.39955 numMergedOcc 0
3 mol 93 unq 0 iso 0 dist 9.22631 9.12539 8.30921 12.8018 13.3531 8.28591 numMergedOcc 0
4 mol 93 unq 1 iso 0 dist 9.22631 9.12539 8.30921 13.0349 10.7398 5.35008 numMergedOcc 0
5 mol 93 unq 2 iso 0 dist 9.22631 4.25258 7.39732 12.8018 13.3531 9.40687 numMergedOcc 0
6 mol 93 unq 3 iso 0 dist 9.22631 4.25258 7.39732 13.0349 10.7398 8.84576 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 8.27883 4.73066 4.3439 5.75428 6.27231 6.05855 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 5.75428 4.73066 6.05855 8.27883 6.27231 4.3439 numMergedOcc 0
9 mol 95 unq 2 iso 0 dist 7.7152 4.20834 4.3439 10.0848 6.27231 6.05855 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 9.02706 6.35793 5.92828 9.39168 6.38762 9.1247 numMergedOcc 0
11 mol 112 unq 1 iso 0 dist 8.47988 4.69658 5.92828 8.0427 6.38762 9.1247 numMergedOcc 0
12 mol 112 unq 2 iso 0 dist 9.39168 6.35793 9.1247 9.02706 6.38762 5.92828 numMergedOcc 0
13 mol 112 unq 3 iso 0 dist 8.0427 4.69658 9.1247 8.47988 6.38762 5.92828 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 9.10524 14.9489 6.76852 10.6728 4.87973 4.94473 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 5.35237 7.89899 4.94473 9.69086 4.87973 6.76852 numMergedOcc 0
16 mol 134 unq 2 iso 0 dist 9.00918 9.39407 6.76852 7.99477 4.87973 4.94473 numMergedOcc 0
17 mol 134 unq 3 iso 0 dist 7.99477 9.39407 4.94473 9.00918 4.87973 6.76852 numMergedOcc 0
18 mol 162 unq 0 iso 0 dist 7.37333 4.68369 8.91326 7.45998 3.77838 8.33649 numMergedOcc 0
19 mol 162 unq 1 iso 0 dist 7.45998 4.68369 8.33649 7.37333 3.77838 8.91326 numMergedOcc 0
20 mol 168 unq 0 iso 0 dist 6.02086 12.7437 8.21227 19.0785 13.6611 7.0961 numMergedOcc 0
21 mol 168 unq 1 iso 0 dist 6.02086 12.7437 8.21227 13.5658 11.4215 6.53038 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 8.90571 9.14919 9.17458 12.3127 6.09215 6.94594 numMergedOcc 0
23 mol 186 unq 1 iso 0 dist 8.90571 9.11577 7.36794 12.3127 6.09215 5.81881 numMergedOcc 0
24 mol 186 unq 2 iso 0 dist 6.61112 12.2442 9.17458 11.4283 6.09215 6.94594 numMergedOcc 0
25 mol 186 unq 3 iso 0 dist 6.61112 11.7398 7.36794 11.4283 6.09215 5.81881 numMergedOcc 0
26 mol 222 unq 0 iso 0 dist 6.74196 6.70898 6.39673 8.36842 8.10209 7.80676 numMergedOcc 0
27 mol 222 unq 1 iso 0 dist 8.36842 6.70898 7.80676 6.74196 8.10209 6.39673 numMergedOcc 0
