0 mol 7 unq 0 iso 0 dist 9.8603 14.6665 7.10621 13.8384 5.72491 5.44992 16.6461 9.67164 13.156 8.0744 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.51421 10.6104 8.41585 10.3237 7.88043 10.2446 4.7739 5.99459 6.88805 8.0744 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 5.51421 10.6104 8.41585 13 8.80762 12.3097 4.7739 5.99459 6.88805 11.7002 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.11056 10.4744 8.86116 5.36722 6.72502 6.58998 6.40447 8.09311 11.6226 9.94429 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 6.11056 10.4744 8.86116 5.36722 6.72502 6.58998 3.96014 9.05357 13.1949 6.88355 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 6.11056 6.9756 8.38394 5.36722 6.72502 6.59374 6.40447 8.09311 6.17155 9.94429 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 6.11056 6.9756 8.38394 5.36722 6.72502 6.59374 3.96014 9.05357 10.3122 6.88355 numMergedOcc 0
7 mol 25 unq 0 iso 0 dist 8.40051 13.466 7.57578 13.0772 6.90155 9.36158 6.29702 4.79873 10.2864 6.86525 numMergedOcc 0
8 mol 25 unq 1 iso 0 dist 8.40051 13.466 7.57578 13.0772 6.90155 9.36158 13.591 9.48085 5.18617 13.7717 numMergedOcc 0
9 mol 25 unq 2 iso 0 dist 8.40051 14.4191 7.17969 13.0772 6.90155 10.1525 6.29702 4.79873 11.4148 6.86525 numMergedOcc 0
10 mol 25 unq 3 iso 0 dist 8.40051 14.4191 7.17969 13.0772 6.90155 10.1525 13.591 9.48085 5.68041 13.7717 numMergedOcc 0
11 mol 25 unq 4 iso 0 dist 8.6396 5.8503 5.04899 13.3963 6.6492 9.20601 5.23233 6.55597 4.69295 8.89681 numMergedOcc 0
12 mol 25 unq 5 iso 0 dist 8.6396 5.8503 5.04899 13.3963 6.6492 9.20601 13.5673 9.71956 12.2542 6.97709 numMergedOcc 0
13 mol 25 unq 6 iso 0 dist 8.6396 5.8503 5.04899 13.3963 6.6492 9.20601 10.4709 7.07751 8.79309 5.5511 numMergedOcc 0
14 mol 25 unq 7 iso 0 dist 8.6396 5.8503 5.04899 13.3963 6.6492 9.20601 10.0172 7.52933 5.03027 7.41888 numMergedOcc 0
15 mol 25 unq 8 iso 0 dist 8.6396 5.8503 5.04899 13.3963 6.6492 9.20601 12.2787 8.23761 8.17061 4.38027 numMergedOcc 0
16 mol 25 unq 9 iso 0 dist 8.6396 5.8503 5.04899 13.3963 6.6492 9.20601 13.591 9.49421 13.6145 11.7199 numMergedOcc 0
17 mol 56 unq 0 iso 0 dist 7.20538 6.93876 8.66265 9.91757 6.77886 6.03623 7.2452 9.03564 6.75591 10.5332 numMergedOcc 0
18 mol 73 unq 0 iso 0 dist 6.18305 4.69583 6.19304 11.4574 8.73253 8.26458 4.21749 8.68662 6.20232 10.9746 numMergedOcc 0
19 mol 73 unq 1 iso 0 dist 6.18305 4.69583 6.19304 11.4574 8.73253 8.26458 5.65986 7.4369 5.70116 7.8972 numMergedOcc 0
20 mol 85 unq 0 iso 0 dist 6.58793 10.1919 7.95579 4.81974 7.33422 6.82174 6.97936 7.7068 6.36397 6.33204 numMergedOcc 0
21 mol 85 unq 1 iso 0 dist 6.58793 9.21014 6.19965 4.81974 7.33422 7.91778 6.97936 7.7068 4.41789 6.33204 numMergedOcc 0
22 mol 85 unq 2 iso 0 dist 6.58793 7.83419 7.66905 4.81974 7.33422 10.121 6.97936 7.7068 5.59906 6.33204 numMergedOcc 0
23 mol 109 unq 0 iso 0 dist 8.3164 11.5656 8.69985 10.9842 5.34214 9.14441 8.08642 7.07971 4.69373 6.8409 numMergedOcc 0
24 mol 115 unq 0 iso 0 dist 5.02717 5.28901 7.30858 4.92962 5.72642 5.61704 5.33827 7.69765 10.3209 7.27912 numMergedOcc 0
25 mol 115 unq 1 iso 0 dist 5.02717 5.28901 7.30858 4.92962 5.72642 5.61704 12.6105 9.42082 15.3161 10.5109 numMergedOcc 0
26 mol 115 unq 2 iso 0 dist 5.02717 6.75472 5.83991 4.92962 5.72642 6.4497 5.33827 7.69765 4.48636 7.27912 numMergedOcc 0
27 mol 115 unq 3 iso 0 dist 5.02717 6.75472 5.83991 4.92962 5.72642 6.4497 12.6105 9.42082 6.63111 10.5109 numMergedOcc 0
28 mol 115 unq 4 iso 0 dist 5.02717 11.0268 7.88312 4.92962 5.72642 7.3094 5.33827 7.69765 11.835 7.27912 numMergedOcc 0
29 mol 115 unq 5 iso 0 dist 5.02717 11.0268 7.88312 4.92962 5.72642 7.3094 12.6105 9.42082 6.07067 10.5109 numMergedOcc 0
30 mol 119 unq 0 iso 0 dist 8.44385 12.1192 9.87172 9.79485 7.99857 7.61939 5.92411 6.99446 6.20019 6.29394 numMergedOcc 0
31 mol 119 unq 1 iso 0 dist 5.63005 10.5268 8.73993 9.79485 8.56342 4.91132 5.92411 7.64052 9.68677 6.29394 numMergedOcc 0
32 mol 119 unq 2 iso 0 dist 5.63005 10.5268 8.73993 6.81112 6.37542 6.08167 5.92411 7.64052 9.68677 9.64502 numMergedOcc 0
33 mol 134 unq 0 iso 0 dist 9.92932 10.5108 8.94367 8.2282 8.20836 9.4027 3.76211 7.21868 8.06642 4.935 numMergedOcc 0
34 mol 134 unq 1 iso 0 dist 9.92932 6.20443 9.86662 8.2282 8.20836 5.12325 3.76211 7.21868 4.00092 4.935 numMergedOcc 0
35 mol 134 unq 2 iso 0 dist 9.55556 11.9294 8.94367 4.02705 8.20836 9.4027 4.63732 7.21868 8.06642 4.935 numMergedOcc 0
36 mol 134 unq 3 iso 0 dist 9.55556 6.36794 9.86662 4.02705 8.20836 5.12325 4.63732 7.21868 4.00092 4.935 numMergedOcc 0
37 mol 143 unq 0 iso 0 dist 8.30654 11.3469 5.99315 6.29937 8.41611 12.7056 9.60065 7.36975 13.1926 9.05786 numMergedOcc 0
38 mol 143 unq 1 iso 0 dist 8.30654 11.3469 5.99315 6.29937 8.41611 12.7056 4.68518 5.40637 7.39837 6.16103 numMergedOcc 0
39 mol 143 unq 2 iso 0 dist 8.30654 11.3469 5.99315 6.49958 7.63338 12.8872 9.60065 7.36975 13.1926 3.75378 numMergedOcc 0
40 mol 143 unq 3 iso 0 dist 8.30654 11.3469 5.99315 6.49958 7.63338 12.8872 4.68518 5.40637 7.39837 8.4697 numMergedOcc 0
41 mol 143 unq 4 iso 0 dist 8.30654 11.3469 5.99315 6.80782 9.03707 7.76364 9.60065 7.36975 13.1926 14.0356 numMergedOcc 0
42 mol 143 unq 5 iso 0 dist 8.30654 11.3469 5.99315 6.80782 9.03707 7.76364 4.68518 5.40637 7.39837 5.41614 numMergedOcc 0
43 mol 143 unq 6 iso 0 dist 8.30654 11.3469 5.99315 5.82537 7.25673 9.23795 9.60065 7.36975 13.1926 9.30534 numMergedOcc 0
44 mol 143 unq 7 iso 0 dist 8.30654 11.3469 5.99315 5.82537 7.25673 9.23795 4.68518 5.40637 7.39837 6.78032 numMergedOcc 0
45 mol 214 unq 0 iso 0 dist 9.51764 6.28065 9.65138 10.5029 6.38157 7.38025 14.8375 7.46481 11.4955 5.73082 numMergedOcc 0
46 mol 214 unq 1 iso 0 dist 9.51764 11.2159 7.14453 10.5029 6.38157 9.35273 14.8375 7.46481 8.459 5.73082 numMergedOcc 0
47 mol 214 unq 2 iso 0 dist 9.51764 6.53326 8.85478 10.5029 6.38157 5.63388 14.8375 7.46481 11.1534 5.73082 numMergedOcc 0
48 mol 214 unq 3 iso 0 dist 5.36829 11.7583 9.65138 8.38755 6.38157 7.38025 5.47184 7.46481 11.4955 5.73082 numMergedOcc 0
49 mol 214 unq 4 iso 0 dist 5.36829 4.98764 7.14453 8.38755 6.38157 9.35273 5.47184 7.46481 8.459 5.73082 numMergedOcc 0
50 mol 214 unq 5 iso 0 dist 5.36829 12.3481 8.85478 8.38755 6.38157 5.63388 5.47184 7.46481 11.1534 5.73082 numMergedOcc 0
51 mol 229 unq 0 iso 0 dist 8.6537 8.65216 8.22528 7.78418 8.92743 11.6847 3.72432 7.27993 5.70473 6.93188 numMergedOcc 0
52 mol 229 unq 1 iso 0 dist 8.6537 10.7439 7.03423 7.78418 8.92743 9.62106 3.72432 7.27993 7.22525 6.93188 numMergedOcc 0
53 mol 229 unq 2 iso 0 dist 5.57702 6.21233 9.87838 7.78418 5.77318 7.7339 3.72432 6.95201 4.61227 6.93188 numMergedOcc 0
54 mol 234 unq 0 iso 0 dist 7.86368 12.0816 9.45496 6.83465 7.5366 5.63086 9.8663 7.81215 12.4252 11.0592 numMergedOcc 0
55 mol 234 unq 1 iso 0 dist 7.86368 6.94762 6.7625 6.83465 7.5366 5.6819 9.8663 7.81215 5.75498 11.0592 numMergedOcc 0
56 mol 259 unq 0 iso 0 dist 9.54857 15.3806 7.46176 12.7168 8.55558 5.60748 5.49348 5.85442 10.067 7.32929 numMergedOcc 0
57 mol 259 unq 1 iso 0 dist 9.54857 15.3806 7.46176 12.7168 8.55558 5.60748 5.13138 6.95511 11.6988 9.55426 numMergedOcc 0
58 mol 259 unq 2 iso 0 dist 6.42725 8.70769 5.30224 12.2782 8.59697 7.31951 11.761 8.03219 4.04513 4.67584 numMergedOcc 0
59 mol 259 unq 3 iso 0 dist 6.42725 8.70769 5.30224 12.2782 8.59697 7.31951 6.09466 6.9899 7.09907 7.32929 numMergedOcc 0
