0 mol 24 unq 0 iso 0 dist 8.86116 8.38394 6.44287 6.72502 6.58998 6.59374 8.09311 11.6226 6.17155 9.94429 5.11636 7.95042 10.9819 8.24948 12.6165 numMergedOcc 0
1 mol 24 unq 0 iso 1 dist 8.38394 8.86116 6.44287 6.72502 6.59374 6.58998 8.09311 6.17155 11.6226 9.94429 5.11636 10.9819 7.95042 8.24948 12.6165 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.86116 8.38394 6.44287 6.72502 6.58998 6.59374 9.05357 13.1949 10.3122 6.88355 5.11636 7.95042 10.9819 8.24948 12.7305 numMergedOcc 0
3 mol 24 unq 1 iso 1 dist 8.38394 8.86116 6.44287 6.72502 6.59374 6.58998 9.05357 10.3122 13.1949 6.88355 5.11636 10.9819 7.95042 8.24948 12.7305 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 5.73819 6.20293 5.06502 8.60739 5.64171 9.06158 6.75943 4.96926 5.41726 4.55347 5.07458 6.66407 10.0168 7.24352 8.34145 numMergedOcc 0
5 mol 43 unq 0 iso 1 dist 6.20293 5.73819 5.06502 8.60739 9.06158 5.64171 6.75943 5.41726 4.96926 4.55347 5.07458 10.0168 6.66407 7.24352 8.34145 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 5.73819 8.93915 5.89973 8.60739 5.64171 11.3891 6.75943 4.96926 10.0383 4.55347 5.07458 6.66407 10.9975 7.24352 8.34145 numMergedOcc 0
7 mol 43 unq 1 iso 1 dist 8.93915 5.73819 5.89973 8.60739 11.3891 5.64171 6.75943 10.0383 4.96926 4.55347 5.07458 10.9975 6.66407 7.24352 8.34145 numMergedOcc 0
8 mol 43 unq 1 iso 0 dist 6.20293 8.93915 6.45462 8.60739 9.06158 11.3891 6.75943 5.41726 10.0383 4.55347 5.07458 10.0168 10.9975 7.24352 8.34145 numMergedOcc 0
9 mol 43 unq 1 iso 1 dist 8.93915 6.20293 6.45462 8.60739 11.3891 9.06158 6.75943 10.0383 5.41726 4.55347 5.07458 10.9975 10.0168 7.24352 8.34145 numMergedOcc 0
10 mol 59 unq 0 iso 0 dist 7.17396 9.21998 6.05545 8.64015 11.0904 12.9211 6.56212 7.31539 11.1607 4.88345 6.08003 12.4823 13.2239 7.17026 8.66724 numMergedOcc 0
11 mol 59 unq 0 iso 1 dist 9.21998 7.17396 6.05545 8.64015 12.9211 11.0904 6.56212 11.1607 7.31539 4.88345 6.08003 13.2239 12.4823 7.17026 8.66724 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 7.30858 5.83991 10.8507 5.72642 5.61704 6.4497 7.69765 10.3209 4.48636 7.27912 5.03039 6.04595 10.5599 8.4965 10.9431 numMergedOcc 0
13 mol 115 unq 0 iso 1 dist 5.83991 7.30858 10.8507 5.72642 6.4497 5.61704 7.69765 4.48636 10.3209 7.27912 5.03039 10.5599 6.04595 8.4965 10.9431 numMergedOcc 0
14 mol 115 unq 1 iso 0 dist 7.30858 5.83991 10.8507 5.72642 5.61704 6.4497 9.42082 15.3161 6.63111 10.5109 5.03039 6.04595 10.5599 8.4965 14.3113 numMergedOcc 0
15 mol 115 unq 1 iso 1 dist 5.83991 7.30858 10.8507 5.72642 6.4497 5.61704 9.42082 6.63111 15.3161 10.5109 5.03039 10.5599 6.04595 8.4965 14.3113 numMergedOcc 0
16 mol 115 unq 2 iso 0 dist 7.30858 7.88312 11.5723 5.72642 5.61704 7.3094 7.69765 10.3209 11.835 7.27912 5.03039 6.04595 11.8378 8.4965 10.9431 numMergedOcc 0
17 mol 115 unq 2 iso 1 dist 7.88312 7.30858 11.5723 5.72642 7.3094 5.61704 7.69765 11.835 10.3209 7.27912 5.03039 11.8378 6.04595 8.4965 10.9431 numMergedOcc 0
18 mol 115 unq 3 iso 0 dist 7.30858 7.88312 11.5723 5.72642 5.61704 7.3094 9.42082 15.3161 6.07067 10.5109 5.03039 6.04595 11.8378 8.4965 14.3113 numMergedOcc 0
19 mol 115 unq 3 iso 1 dist 7.88312 7.30858 11.5723 5.72642 7.3094 5.61704 9.42082 6.07067 15.3161 10.5109 5.03039 11.8378 6.04595 8.4965 14.3113 numMergedOcc 0
20 mol 115 unq 2 iso 0 dist 5.83991 7.88312 8.02349 5.72642 6.4497 7.3094 7.69765 4.48636 11.835 7.27912 5.03039 10.5599 11.8378 8.4965 10.9431 numMergedOcc 0
21 mol 115 unq 2 iso 1 dist 7.88312 5.83991 8.02349 5.72642 7.3094 6.4497 7.69765 11.835 4.48636 7.27912 5.03039 11.8378 10.5599 8.4965 10.9431 numMergedOcc 0
22 mol 115 unq 3 iso 0 dist 5.83991 7.88312 8.02349 5.72642 6.4497 7.3094 9.42082 6.63111 6.07067 10.5109 5.03039 10.5599 11.8378 8.4965 14.3113 numMergedOcc 0
23 mol 115 unq 3 iso 1 dist 7.88312 5.83991 8.02349 5.72642 7.3094 6.4497 9.42082 6.07067 6.63111 10.5109 5.03039 11.8378 10.5599 8.4965 14.3113 numMergedOcc 0
24 mol 134 unq 0 iso 0 dist 8.94367 9.86662 6.81259 8.20836 9.4027 5.12325 7.21868 8.06642 4.00092 4.935 16.4114 14.3561 9.71716 8.48313 12.2382 numMergedOcc 0
25 mol 134 unq 0 iso 1 dist 9.86662 8.94367 6.81259 8.20836 5.12325 9.4027 7.21868 4.00092 8.06642 4.935 16.4114 9.71716 14.3561 8.48313 12.2382 numMergedOcc 0
26 mol 134 unq 1 iso 0 dist 8.94367 9.86662 6.81259 8.20836 9.4027 5.12325 7.21868 8.06642 4.00092 4.935 12.8086 11.0808 9.1998 6.99345 11.2397 numMergedOcc 0
27 mol 134 unq 1 iso 1 dist 9.86662 8.94367 6.81259 8.20836 5.12325 9.4027 7.21868 4.00092 8.06642 4.935 12.8086 9.1998 11.0808 6.99345 11.2397 numMergedOcc 0
28 mol 134 unq 2 iso 0 dist 8.94367 9.86662 6.81259 8.20836 9.4027 5.12325 7.21868 8.06642 4.00092 4.935 7.41373 9.33094 8.69531 5.11043 8.62504 numMergedOcc 0
29 mol 134 unq 2 iso 1 dist 9.86662 8.94367 6.81259 8.20836 5.12325 9.4027 7.21868 4.00092 8.06642 4.935 7.41373 8.69531 9.33094 5.11043 8.62504 numMergedOcc 0
30 mol 152 unq 0 iso 0 dist 5.87555 6.70283 5.42328 8.28642 5.70788 9.35627 6.70693 4.94983 5.39112 4.71678 9.84297 10.4285 14.437 6.92726 10.4667 numMergedOcc 0
31 mol 152 unq 0 iso 1 dist 6.70283 5.87555 5.42328 8.28642 9.35627 5.70788 6.70693 5.39112 4.94983 4.71678 9.84297 14.437 10.4285 6.92726 10.4667 numMergedOcc 0
32 mol 152 unq 1 iso 0 dist 5.87555 8.67331 5.54906 8.28642 5.70788 11.2078 6.70693 4.94983 9.67475 4.71678 9.84297 10.4285 15.2732 6.92726 10.4667 numMergedOcc 0
33 mol 152 unq 1 iso 1 dist 8.67331 5.87555 5.54906 8.28642 11.2078 5.70788 6.70693 9.67475 4.94983 4.71678 9.84297 15.2732 10.4285 6.92726 10.4667 numMergedOcc 0
34 mol 152 unq 1 iso 0 dist 6.70283 8.67331 6.4896 8.28642 9.35627 11.2078 6.70693 5.39112 9.67475 4.71678 9.84297 14.437 15.2732 6.92726 10.4667 numMergedOcc 0
35 mol 152 unq 1 iso 1 dist 8.67331 6.70283 6.4896 8.28642 11.2078 9.35627 6.70693 9.67475 5.39112 4.71678 9.84297 15.2732 14.437 6.92726 10.4667 numMergedOcc 0
36 mol 178 unq 0 iso 0 dist 6.69288 6.43573 5.34677 4.92088 10.1489 8.27339 9.11204 8.44333 6.8202 7.79894 6.42973 7.06025 10.0638 8.25282 9.32938 numMergedOcc 0
37 mol 178 unq 0 iso 1 dist 6.43573 6.69288 5.34677 4.92088 8.27339 10.1489 9.11204 6.8202 8.44333 7.79894 6.42973 10.0638 7.06025 8.25282 9.32938 numMergedOcc 0
38 mol 178 unq 1 iso 0 dist 6.69288 7.17202 11.7381 4.92088 10.1489 9.79302 9.11204 8.44333 14.9499 7.79894 6.42973 7.06025 13.2692 8.25282 9.32938 numMergedOcc 0
39 mol 178 unq 1 iso 1 dist 7.17202 6.69288 11.7381 4.92088 9.79302 10.1489 9.11204 14.9499 8.44333 7.79894 6.42973 13.2692 7.06025 8.25282 9.32938 numMergedOcc 0
40 mol 178 unq 2 iso 0 dist 6.69288 8.81551 14.0703 4.92088 10.1489 8.65097 9.11204 8.44333 14.2467 7.79894 6.42973 7.06025 15.0672 8.25282 9.32938 numMergedOcc 0
41 mol 178 unq 2 iso 1 dist 8.81551 6.69288 14.0703 4.92088 8.65097 10.1489 9.11204 14.2467 8.44333 7.79894 6.42973 15.0672 7.06025 8.25282 9.32938 numMergedOcc 0
42 mol 178 unq 1 iso 0 dist 6.43573 7.17202 9.89739 4.92088 8.27339 9.79302 9.11204 6.8202 14.9499 7.79894 6.42973 10.0638 13.2692 8.25282 9.32938 numMergedOcc 0
43 mol 178 unq 1 iso 1 dist 7.17202 6.43573 9.89739 4.92088 9.79302 8.27339 9.11204 14.9499 6.8202 7.79894 6.42973 13.2692 10.0638 8.25282 9.32938 numMergedOcc 0
44 mol 178 unq 2 iso 0 dist 6.43573 8.81551 10.5529 4.92088 8.27339 8.65097 9.11204 6.8202 14.2467 7.79894 6.42973 10.0638 15.0672 8.25282 9.32938 numMergedOcc 0
45 mol 178 unq 2 iso 1 dist 8.81551 6.43573 10.5529 4.92088 8.65097 8.27339 9.11204 14.2467 6.8202 7.79894 6.42973 15.0672 10.0638 8.25282 9.32938 numMergedOcc 0
46 mol 178 unq 2 iso 0 dist 7.17202 8.81551 5.18005 4.92088 9.79302 8.65097 9.11204 14.9499 14.2467 7.79894 6.42973 13.2692 15.0672 8.25282 9.32938 numMergedOcc 0
47 mol 178 unq 2 iso 1 dist 8.81551 7.17202 5.18005 4.92088 8.65097 9.79302 9.11204 14.2467 14.9499 7.79894 6.42973 15.0672 13.2692 8.25282 9.32938 numMergedOcc 0
48 mol 227 unq 0 iso 0 dist 7.22101 7.09863 4.39704 8.38865 11.0628 12.9587 5.23634 5.0317 5.83175 7.3164 4.1511 9.91384 10.3016 5.28771 6.09335 numMergedOcc 0
49 mol 227 unq 0 iso 1 dist 7.09863 7.22101 4.39704 8.38865 12.9587 11.0628 5.23634 5.83175 5.0317 7.3164 4.1511 10.3016 9.91384 5.28771 6.09335 numMergedOcc 0
50 mol 229 unq 0 iso 0 dist 8.22528 7.03423 5.57838 8.92743 11.6847 9.62106 7.27993 5.70473 7.22525 6.93188 11.0437 16.8558 14.0816 6.42694 12.4584 numMergedOcc 0
51 mol 229 unq 0 iso 1 dist 7.03423 8.22528 5.57838 8.92743 9.62106 11.6847 7.27993 7.22525 5.70473 6.93188 11.0437 14.0816 16.8558 6.42694 12.4584 numMergedOcc 0
52 mol 229 unq 1 iso 0 dist 8.22528 7.03423 5.57838 8.92743 11.6847 9.62106 7.27993 5.70473 7.22525 6.93188 11.9989 16.8118 16.0361 7.63917 11.5308 numMergedOcc 0
53 mol 229 unq 1 iso 1 dist 7.03423 8.22528 5.57838 8.92743 9.62106 11.6847 7.27993 7.22525 5.70473 6.93188 11.9989 16.0361 16.8118 7.63917 11.5308 numMergedOcc 0
54 mol 236 unq 0 iso 0 dist 9.81562 7.68742 5.79505 8.50331 7.22918 9.05842 9.3206 4.27181 4.89609 5.59363 11.5307 16.0783 16.07 9.14068 13.9166 numMergedOcc 0
55 mol 236 unq 0 iso 1 dist 7.68742 9.81562 5.79505 8.50331 9.05842 7.22918 9.3206 4.89609 4.27181 5.59363 11.5307 16.07 16.0783 9.14068 13.9166 numMergedOcc 0
56 mol 236 unq 1 iso 0 dist 9.81562 6.27581 9.90963 8.50331 7.22918 7.00028 9.3206 4.27181 10.5774 5.59363 11.5307 16.0783 10.0129 9.14068 13.9166 numMergedOcc 0
57 mol 236 unq 1 iso 1 dist 6.27581 9.81562 9.90963 8.50331 7.00028 7.22918 9.3206 10.5774 4.27181 5.59363 11.5307 10.0129 16.0783 9.14068 13.9166 numMergedOcc 0
58 mol 236 unq 1 iso 0 dist 7.68742 6.27581 11.3368 8.50331 9.05842 7.00028 9.3206 4.89609 10.5774 5.59363 11.5307 16.07 10.0129 9.14068 13.9166 numMergedOcc 0
59 mol 236 unq 1 iso 1 dist 6.27581 7.68742 11.3368 8.50331 7.00028 9.05842 9.3206 10.5774 4.89609 5.59363 11.5307 10.0129 16.07 9.14068 13.9166 numMergedOcc 0
