0 mol 58 unq 0 iso 0 dist 5.40287 5.52874 5.38524 6.82279 8.66539 5.79773 10.079 5.61579 6.81627 11.715 9.02602 8.69057 5.47421 10.8779 7.32874 numMergedOcc 0
1 mol 58 unq 1 iso 0 dist 5.40287 5.52874 5.38524 6.82279 8.66539 5.79773 10.079 5.61579 6.81627 11.715 14.5211 13.1897 9.7274 14.4309 9.55426 numMergedOcc 0
2 mol 58 unq 2 iso 0 dist 5.40287 5.52874 5.38524 9.02602 8.69057 5.47421 10.079 5.61579 6.81627 7.32874 14.5211 13.1897 9.7274 5.90225 9.55426 numMergedOcc 0
3 mol 58 unq 3 iso 0 dist 5.40287 9.02602 8.69057 6.82279 8.66539 10.8779 10.079 5.61579 7.32874 11.715 5.52874 5.38524 5.47421 5.79773 6.81627 numMergedOcc 0
4 mol 58 unq 4 iso 0 dist 5.40287 9.02602 8.69057 6.82279 8.66539 10.8779 10.079 5.61579 7.32874 11.715 14.5211 13.1897 5.90225 14.4309 9.55426 numMergedOcc 0
5 mol 58 unq 5 iso 0 dist 5.40287 9.02602 8.69057 5.52874 5.38524 5.47421 10.079 5.61579 7.32874 6.81627 14.5211 13.1897 5.90225 9.7274 9.55426 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 9.54537 4.31214 7.80898 14.437 7.51139 12.1547 12.6459 12.1193 9.36773 16.8013 6.91627 12.785 5.57085 17.4556 8.31336 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 5.15951 7.41993 7.86666 13.345 9.77497 17.2949 14.3528 13.0886 7.34473 21.5605 12.3669 14.3511 7 24.0538 8.58044 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 5.15951 7.41993 7.86666 13.345 9.77497 17.2949 14.3528 13.0886 7.34473 21.5605 14.2751 15.7916 8.40993 24.4429 9.97763 numMergedOcc 0
9 mol 117 unq 0 iso 0 dist 8.15473 10.0436 8.19331 6.81312 8.85711 7.21564 8.98848 3.55765 7.83136 7.0603 14.6144 10.4223 7.22206 9.3584 7.90328 numMergedOcc 0
10 mol 117 unq 1 iso 0 dist 8.15473 6.81312 8.85711 10.0436 8.19331 7.21564 8.98848 3.55765 7.0603 7.83136 14.6144 10.4223 9.3584 7.22206 7.90328 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 9.77567 5.29694 6.59889 12.1481 6.70693 7.65448 13.2594 5.39112 8.56324 6.70283 15.875 10.4895 10.6875 5.49936 7.16148 numMergedOcc 0
12 mol 152 unq 1 iso 0 dist 9.77567 12.1481 6.70693 5.29694 6.59889 7.65448 14.2479 4.94983 5.87555 10.399 15.875 10.4895 5.49936 10.6875 8.87437 numMergedOcc 0
13 mol 152 unq 2 iso 0 dist 9.77567 12.1481 6.70693 5.29694 6.59889 7.65448 13.2594 5.39112 6.70283 8.56324 15.875 10.4895 5.49936 10.6875 7.16148 numMergedOcc 0
14 mol 152 unq 3 iso 0 dist 9.77567 12.1481 6.70693 5.29694 6.59889 7.65448 18.7855 9.67475 8.67331 14.1618 15.875 10.4895 5.49936 10.6875 8.05741 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 9.24772 7.89844 9.76212 5.10258 8.59874 6.01247 14.6912 12.9532 9.1374 9.94371 16.1714 13.2783 8.88798 12.6324 5.98885 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 9.24772 7.89844 9.76212 5.10258 8.59874 6.01247 14.6912 12.9532 9.1374 9.94371 19.945 18.2853 12.1628 16.5106 9.15386 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 5.09756 6.15341 6.61112 5.01462 8.90571 7.09479 13.1651 11.0961 7.54065 14.4482 19.714 18.4751 13.8792 18.5655 9.70748 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 5.09756 6.15341 6.61112 5.01462 8.90571 7.09479 13.1651 11.0961 7.54065 14.4482 9.77429 11.456 5.74635 10.3628 8.87694 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 8.55819 5.30529 6.99769 10.5504 8.79428 6.77699 11.1386 5.76843 6.65832 6.60589 12.7033 6.8692 11.328 8.49799 9.16166 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 8.55819 5.30529 6.99769 12.7033 6.8692 11.328 11.1386 5.76843 6.65832 9.16166 10.5504 8.79428 6.77699 8.49799 6.60589 numMergedOcc 0
21 mol 224 unq 2 iso 0 dist 8.55819 10.5504 8.79428 5.30529 6.99769 6.77699 13.6981 7.05804 6.57273 10.103 14.8764 13.2325 4.70378 10.9861 8.95269 numMergedOcc 0
22 mol 224 unq 3 iso 0 dist 8.55819 10.5504 8.79428 5.30529 6.99769 6.77699 13.6981 7.05804 6.57273 10.103 12.7033 6.8692 8.49799 11.328 5.78342 numMergedOcc 0
23 mol 224 unq 4 iso 0 dist 8.55819 10.5504 8.79428 5.30529 6.99769 6.77699 11.1386 5.76843 6.60589 6.65832 12.7033 6.8692 8.49799 11.328 9.16166 numMergedOcc 0
24 mol 224 unq 5 iso 0 dist 8.55819 10.5504 8.79428 12.7033 6.8692 8.49799 13.6981 7.05804 6.57273 5.78342 14.8764 13.2325 4.70378 11.5372 8.95269 numMergedOcc 0
25 mol 224 unq 6 iso 0 dist 8.55819 10.5504 8.79428 12.7033 6.8692 8.49799 11.1386 5.76843 6.60589 9.16166 5.30529 6.99769 6.77699 11.328 6.65832 numMergedOcc 0
26 mol 224 unq 7 iso 0 dist 8.55819 12.7033 6.8692 5.30529 6.99769 11.328 13.6981 7.05804 5.78342 10.103 14.8764 13.2325 11.5372 10.9861 8.95269 numMergedOcc 0
27 mol 224 unq 8 iso 0 dist 8.55819 12.7033 6.8692 5.30529 6.99769 11.328 13.6981 7.05804 5.78342 10.103 10.5504 8.79428 8.49799 6.77699 6.57273 numMergedOcc 0
28 mol 224 unq 9 iso 0 dist 8.55819 12.7033 6.8692 5.30529 6.99769 11.328 11.1386 5.76843 9.16166 6.65832 10.5504 8.79428 8.49799 6.77699 6.60589 numMergedOcc 0
29 mol 224 unq 10 iso 0 dist 8.55819 12.7033 6.8692 10.5504 8.79428 8.49799 13.6981 7.05804 5.78342 6.57273 14.8764 13.2325 11.5372 4.70378 8.95269 numMergedOcc 0
30 mol 224 unq 11 iso 0 dist 8.55819 12.7033 6.8692 10.5504 8.79428 8.49799 11.1386 5.76843 9.16166 6.60589 5.30529 6.99769 11.328 6.77699 6.65832 numMergedOcc 0
31 mol 229 unq 0 iso 0 dist 9.69367 12.61 7.27993 12.7466 9.51168 5.1556 14.7537 7.22525 7.03423 11.9282 14.04 11.9869 6.84129 10.4478 9.06952 numMergedOcc 0
32 mol 229 unq 1 iso 0 dist 9.69367 12.61 7.27993 6.23286 6.95201 7.0298 14.7537 7.22525 7.03423 11.4362 14.04 11.9869 6.84129 10.2557 9.06952 numMergedOcc 0
33 mol 259 unq 0 iso 0 dist 9.93282 5.69584 5.85442 15.3167 6.9899 9.98105 11.283 10.067 7.46176 12.0576 6.00315 10.3406 6.96053 15.8535 7.88519 numMergedOcc 0
34 mol 259 unq 1 iso 0 dist 9.93282 5.69584 5.85442 15.3167 6.9899 9.98105 11.283 10.067 7.46176 12.0576 6.72493 12.8546 7.64658 16.9228 7.84554 numMergedOcc 0
35 mol 259 unq 2 iso 0 dist 9.93282 5.69584 5.85442 15.3167 6.9899 9.98105 11.283 10.067 7.46176 12.0576 11.1715 16.0301 10.5239 17.9439 9.18903 numMergedOcc 0
36 mol 259 unq 3 iso 0 dist 8.90555 6.00315 9.46361 5.69584 6.95511 6.96053 13.2261 12.2293 8.13497 10.3935 16.0777 18.7675 10.582 15.7715 8.53687 numMergedOcc 0
37 mol 259 unq 4 iso 0 dist 8.90555 6.00315 9.46361 5.69584 6.95511 6.96053 11.283 11.6988 7.88519 7.46176 6.72493 12.8903 4.86771 7.64658 7.84554 numMergedOcc 0
38 mol 259 unq 5 iso 0 dist 8.90555 6.00315 9.46361 5.69584 6.95511 6.96053 11.283 11.6988 7.88519 7.46176 11.1715 17.104 10.4881 10.5239 9.18903 numMergedOcc 0
39 mol 259 unq 6 iso 0 dist 8.90555 5.69584 6.95511 6.00315 9.46361 6.96053 11.283 11.6988 7.46176 7.88519 6.72493 12.8903 7.64658 4.86771 7.84554 numMergedOcc 0
40 mol 259 unq 7 iso 0 dist 8.90555 5.69584 6.95511 6.00315 9.46361 6.96053 11.283 11.6988 7.46176 7.88519 11.1715 17.104 10.5239 10.4881 9.18903 numMergedOcc 0
