0 mol 7 unq 0 iso 0 dist 5.77374 8.57437 5.63739 9.30196 6.0323 10.2084 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.57437 5.77374 5.63739 13.63 8.85869 13.8453 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 7.2159 8.93093 9.1656 6.57228 9.77521 14.5174 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 7.28917 7.02173 4.18809 4.16192 9.94756 10.0228 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 5.58346 9.10386 5.47475 12.2435 7.84699 8.40844 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 5.58346 9.10386 5.47475 10.362 7.53504 8.66342 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 9.10386 5.58346 5.47475 12.2435 8.40844 7.84699 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 9.10386 5.58346 5.47475 14.2654 7.02351 12.1654 numMergedOcc 0
8 mol 73 unq 4 iso 0 dist 9.10386 5.58346 5.47475 10.362 8.66342 7.53504 numMergedOcc 0
9 mol 73 unq 5 iso 0 dist 9.78545 5.68726 6.18163 14.5223 6.95094 12.0846 numMergedOcc 0
10 mol 73 unq 6 iso 0 dist 5.68726 9.78545 6.18163 9.08204 7.23435 12.2149 numMergedOcc 0
11 mol 73 unq 7 iso 0 dist 9.97998 7.46882 6.18163 11.7502 6.95094 12.0846 numMergedOcc 0
12 mol 73 unq 8 iso 0 dist 7.46882 9.97998 6.18163 6.44802 7.23435 12.2149 numMergedOcc 0
13 mol 86 unq 0 iso 0 dist 8.70136 8.52942 6.69682 5.59145 9.64554 11.3591 numMergedOcc 0
14 mol 86 unq 1 iso 0 dist 8.52942 8.70136 6.69682 7.80472 9.29934 13.8423 numMergedOcc 0
15 mol 86 unq 2 iso 0 dist 8.52942 8.70136 6.69682 6.52017 6.7293 10.162 numMergedOcc 0
16 mol 88 unq 0 iso 0 dist 9.4046 9.47957 5.60823 7.17073 6.41105 10.5281 numMergedOcc 0
17 mol 102 unq 0 iso 0 dist 8.07962 9.54857 7.56811 7.92108 9.61113 7.59973 numMergedOcc 0
18 mol 102 unq 1 iso 0 dist 8.07962 9.54857 7.56811 4.9259 7.73836 10.8539 numMergedOcc 0
19 mol 102 unq 2 iso 0 dist 9.54857 8.07962 7.56811 7.92108 7.59973 9.61113 numMergedOcc 0
20 mol 102 unq 3 iso 0 dist 7.58908 9.32058 7.56811 4.51114 9.61113 7.59973 numMergedOcc 0
21 mol 102 unq 4 iso 0 dist 7.58908 9.32058 7.56811 9.29865 7.73836 10.8539 numMergedOcc 0
22 mol 102 unq 5 iso 0 dist 9.32058 7.58908 7.56811 4.51114 7.59973 9.61113 numMergedOcc 0
23 mol 108 unq 0 iso 0 dist 9.82453 8.79452 9.29398 10.5469 7.58484 13.6841 numMergedOcc 0
24 mol 108 unq 1 iso 0 dist 8.79452 9.82453 9.29398 7.94102 7.59313 10.9872 numMergedOcc 0
25 mol 119 unq 0 iso 0 dist 9.2167 6.67306 7.15643 6.32623 9.29439 11.0387 numMergedOcc 0
26 mol 183 unq 0 iso 0 dist 9.92635 5.83335 14.4206 15.7519 9.81282 21.2062 numMergedOcc 0
27 mol 183 unq 1 iso 0 dist 7.85507 9.86506 15.9375 15.2905 9.81282 24.8513 numMergedOcc 0
28 mol 183 unq 2 iso 0 dist 7.85507 7.86724 14.4206 15.2905 9.81282 21.2062 numMergedOcc 0
29 mol 199 unq 0 iso 0 dist 7.16849 8.22146 8.95041 4.98653 7.29716 11.8736 numMergedOcc 0
30 mol 205 unq 0 iso 0 dist 9.32657 6.21409 6.26321 14.0402 8.21112 13.8569 numMergedOcc 0
31 mol 205 unq 1 iso 0 dist 9.32657 6.21409 6.26321 11.0093 7.06533 11.3296 numMergedOcc 0
32 mol 205 unq 2 iso 0 dist 9.32657 6.21409 6.26321 7.30488 5.94835 6.76947 numMergedOcc 0
33 mol 205 unq 3 iso 0 dist 6.21409 9.32657 6.26321 7.30488 6.76947 5.94835 numMergedOcc 0
34 mol 219 unq 0 iso 0 dist 9.52151 8.62654 16.4807 6.28221 7.98941 14.8072 numMergedOcc 0
35 mol 250 unq 0 iso 0 dist 8.62074 7.55313 6.91019 11.1655 9.08048 14.4558 numMergedOcc 0
36 mol 259 unq 0 iso 0 dist 7.97113 5.22111 4.70261 9.69102 9.2772 11.5263 numMergedOcc 0
37 mol 259 unq 1 iso 0 dist 8.38479 8.53598 4.70261 4.76806 9.2772 11.5263 numMergedOcc 0
38 mol 266 unq 0 iso 0 dist 3.90274 7.49024 9.45269 4.55986 6.35457 10.4802 numMergedOcc 0
39 mol 266 unq 1 iso 0 dist 7.49024 3.90274 9.45269 8.79928 9.27042 12.3506 numMergedOcc 0
40 mol 274 unq 0 iso 0 dist 8.15217 7.62562 6.07831 4.77555 5.38704 8.05503 numMergedOcc 0
41 mol 274 unq 1 iso 0 dist 8.15217 7.62562 6.07831 6.30262 8.26695 5.59151 numMergedOcc 0
42 mol 274 unq 2 iso 0 dist 7.62562 8.15217 6.07831 7.60168 7.59956 11.2121 numMergedOcc 0
43 mol 274 unq 3 iso 0 dist 7.62562 8.15217 6.07831 4.77555 8.05503 5.38704 numMergedOcc 0
44 mol 274 unq 4 iso 0 dist 7.62562 8.15217 6.07831 6.30262 5.59151 8.26695 numMergedOcc 0
45 mol 274 unq 5 iso 0 dist 8.26851 8.14634 5.09461 8.77987 7.24089 10.0585 numMergedOcc 0
46 mol 274 unq 6 iso 0 dist 8.26851 8.14634 5.09461 10.518 9.29005 8.16746 numMergedOcc 0
47 mol 274 unq 7 iso 0 dist 8.14634 8.26851 5.09461 10.518 8.16746 9.29005 numMergedOcc 0
