0 mol 19 unq 0 iso 0 dist 7.20519 7.82528 10.4988 15.119 19.7849 9.85134 10.0411 14.2009 6.38574 6.59113 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 7.20519 7.82528 10.4988 4.97119 10.741 5.82366 10.0411 14.2009 6.38574 5.31883 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 7.20519 9.80108 5.5841 9.32205 10.3056 8.19695 10.3996 11.0464 7.40236 3.73148 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 7.20519 9.80108 5.5841 4.96411 7.75618 7.02548 10.3996 11.0464 7.40236 6.08459 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 8.4674 6.20943 5.14627 10.943 14.129 9.85134 4.44441 10.1278 6.38574 6.59113 numMergedOcc 0
5 mol 19 unq 5 iso 0 dist 8.4674 6.20943 5.14627 4.64838 6.41575 5.82366 4.44441 10.1278 6.38574 5.31883 numMergedOcc 0
6 mol 19 unq 6 iso 0 dist 4.54938 7.82528 5.14627 15.119 14.129 9.85134 10.0411 10.1278 6.38574 6.59113 numMergedOcc 0
7 mol 19 unq 7 iso 0 dist 4.54938 7.82528 5.14627 4.97119 6.41575 5.82366 10.0411 10.1278 6.38574 5.31883 numMergedOcc 0
8 mol 19 unq 8 iso 0 dist 4.51865 6.20943 4.69858 10.943 13.212 9.85134 4.44441 7.7312 6.38574 6.59113 numMergedOcc 0
9 mol 19 unq 9 iso 0 dist 4.51865 6.20943 4.69858 4.64838 6.41423 5.82366 4.44441 7.7312 6.38574 5.31883 numMergedOcc 0
10 mol 19 unq 10 iso 0 dist 4.51865 8.58657 6.74265 13.0631 13.287 8.19695 12.323 11.6815 7.40236 3.73148 numMergedOcc 0
11 mol 19 unq 11 iso 0 dist 4.51865 8.58657 6.74265 7.08342 8.40416 7.02548 12.323 11.6815 7.40236 6.08459 numMergedOcc 0
12 mol 19 unq 12 iso 0 dist 6.864 7.82528 4.69858 15.119 13.212 9.85134 10.0411 7.7312 6.38574 6.59113 numMergedOcc 0
13 mol 19 unq 13 iso 0 dist 6.864 7.82528 4.69858 4.97119 6.41423 5.82366 10.0411 7.7312 6.38574 5.31883 numMergedOcc 0
14 mol 19 unq 14 iso 0 dist 6.864 8.58657 5.5841 13.0631 10.3056 8.19695 12.323 11.0464 7.40236 3.73148 numMergedOcc 0
15 mol 19 unq 15 iso 0 dist 6.864 8.58657 5.5841 7.08342 7.75618 7.02548 12.323 11.0464 7.40236 6.08459 numMergedOcc 0
16 mol 73 unq 0 iso 0 dist 9.38498 8.70133 13.4082 5.11416 13.8696 7.10439 4.73407 6.23522 7.78587 7.98468 numMergedOcc 0
17 mol 73 unq 1 iso 0 dist 5.93252 5.64598 9.77992 8.44406 13.6162 7.10439 3.85805 9.10566 7.78587 7.98468 numMergedOcc 0
18 mol 73 unq 2 iso 0 dist 9.96396 8.70133 7.41074 5.11416 9.24757 7.10439 4.73407 11.3218 7.78587 7.98468 numMergedOcc 0
19 mol 73 unq 3 iso 0 dist 6.19304 4.65521 7.41074 6.56633 9.24757 7.10439 5.17781 11.3218 7.78587 7.98468 numMergedOcc 0
20 mol 73 unq 4 iso 0 dist 9.75218 8.70133 15.9882 5.11416 13.0145 7.10439 4.73407 12.8353 7.78587 7.98468 numMergedOcc 0
21 mol 92 unq 0 iso 0 dist 7.4729 5.81965 6.99832 8.55834 10.5753 7.1539 12.3859 9.68271 7.03417 9.04084 numMergedOcc 0
22 mol 92 unq 1 iso 0 dist 7.4729 5.81965 6.99832 9.50382 6.95572 5.39745 12.3859 9.68271 7.03417 3.87825 numMergedOcc 0
23 mol 92 unq 2 iso 0 dist 6.82344 9.70512 6.99832 7.76866 10.5753 7.1539 11.3622 9.68271 7.03417 9.04084 numMergedOcc 0
24 mol 92 unq 3 iso 0 dist 6.82344 9.70512 6.99832 7.56363 6.95572 5.39745 11.3622 9.68271 7.03417 3.87825 numMergedOcc 0
25 mol 156 unq 0 iso 0 dist 8.34702 7.36119 11.787 5.81563 13.0658 6.05323 3.79489 11.8936 8.22067 5.64188 numMergedOcc 0
26 mol 156 unq 1 iso 0 dist 9.06726 7.36119 7.71144 5.81563 11.5017 6.05323 3.79489 12.1503 8.22067 5.64188 numMergedOcc 0
27 mol 156 unq 2 iso 0 dist 8.33171 7.36119 9.22231 5.81563 10.0063 6.05323 3.79489 11.8938 8.22067 5.64188 numMergedOcc 0
28 mol 181 unq 0 iso 0 dist 9.1374 6.71012 4.77278 6.6251 6.2479 7.13252 11.618 11.8368 7.61421 13.4378 numMergedOcc 0
29 mol 181 unq 1 iso 0 dist 5.98885 6.71012 9.14057 6.6251 7.99195 7.13252 11.618 15.9184 7.61421 13.4378 numMergedOcc 0
30 mol 181 unq 2 iso 0 dist 9.15386 6.71012 11.6919 6.6251 12.8533 7.13252 11.618 17.4077 7.61421 13.4378 numMergedOcc 0
31 mol 181 unq 3 iso 0 dist 7.81386 4.93785 6.7991 7.77758 5.94469 7.05653 6.13927 8.29467 6.91878 3.63671 numMergedOcc 0
32 mol 234 unq 0 iso 0 dist 9.45496 9.5707 15.9563 10.0059 17.6227 7.43663 12.7879 18.009 5.69634 6.67757 numMergedOcc 0
33 mol 234 unq 1 iso 0 dist 6.7625 9.5707 14.4106 10.0059 12.6238 7.43663 12.7879 15.3921 5.69634 6.67757 numMergedOcc 0
34 mol 235 unq 0 iso 0 dist 5.4638 8.21247 4.65302 7.60081 9.55668 7.95766 4.75609 8.08965 9.11149 6.82702 numMergedOcc 0
35 mol 256 unq 0 iso 0 dist 8.29103 5.24676 4.22352 5.28793 9.4406 7.48269 6.73995 8.97872 5.85613 5.59732 numMergedOcc 0
36 mol 256 unq 1 iso 0 dist 8.29103 5.24676 4.22352 4.99672 10.6676 6.71249 6.73995 8.97872 5.85613 3.96807 numMergedOcc 0
37 mol 256 unq 2 iso 0 dist 8.29103 5.24676 4.22352 7.7384 12.7661 9.18903 6.73995 8.97872 5.85613 11.141 numMergedOcc 0
38 mol 259 unq 0 iso 0 dist 7.88519 7.48005 11.6195 8.81835 7.98231 8.71497 6.65799 12.9913 9.28024 9.75001 numMergedOcc 0
39 mol 259 unq 1 iso 0 dist 7.84554 7.48005 11.8736 8.81835 11.6972 8.71497 6.65799 14.3297 9.28024 9.75001 numMergedOcc 0
40 mol 259 unq 2 iso 0 dist 7.46176 7.48005 5.79468 8.81835 7.08526 8.71497 6.65799 11.9533 9.28024 9.75001 numMergedOcc 0
41 mol 259 unq 3 iso 0 dist 5.30224 8.37865 5.31048 8.75685 10.4552 8.71497 9.53031 11.1801 9.28024 9.75001 numMergedOcc 0
42 mol 259 unq 4 iso 0 dist 9.18903 7.48005 12.6649 8.81835 15.8414 8.71497 6.65799 15.5673 9.28024 9.75001 numMergedOcc 0
43 mol 264 unq 0 iso 0 dist 9.361 9.5784 9.85579 7.52936 13.2142 7.34094 11.147 11.9373 8.56867 13.0664 numMergedOcc 0
44 mol 264 unq 1 iso 0 dist 9.361 9.5784 9.85579 7.52936 13.2142 7.34094 10.0018 11.9269 6.29872 10.4666 numMergedOcc 0
45 mol 264 unq 2 iso 0 dist 6.24356 9.5784 9.67998 7.52936 5.93616 7.34094 11.147 15.2551 8.56867 13.0664 numMergedOcc 0
46 mol 264 unq 3 iso 0 dist 6.24356 9.5784 9.67998 7.52936 5.93616 7.34094 10.0018 13.3874 6.29872 10.4666 numMergedOcc 0
