0 mol 8 unq 0 iso 0 dist 9.00925 9.95165 14.4767 15.9496 20.5527 6.82379 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.00925 9.95165 14.4767 14.678 20.0524 6.24978 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 9.00925 9.95165 14.4767 17.3707 21.2502 9.66439 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 9.00925 9.95165 14.4767 12.915 14.0169 7.3915 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 9.50382 9.23617 4.20374 11.8354 9.69454 7.48847 numMergedOcc 0
5 mol 19 unq 1 iso 0 dist 9.50382 9.23617 4.20374 14.4019 10.6173 6.92532 numMergedOcc 0
6 mol 19 unq 2 iso 0 dist 9.50382 9.23617 4.20374 10.38 10.1088 6.36455 numMergedOcc 0
7 mol 19 unq 3 iso 0 dist 8.76559 8.59114 4.20374 5.67097 9.69454 7.48847 numMergedOcc 0
8 mol 19 unq 4 iso 0 dist 8.76559 8.59114 4.20374 14.3476 10.6173 6.92532 numMergedOcc 0
9 mol 19 unq 5 iso 0 dist 8.76559 8.59114 4.20374 12.7 10.1088 6.36455 numMergedOcc 0
10 mol 51 unq 0 iso 0 dist 9.4097 9.42071 7.2168 10.1569 12.7025 7.76282 numMergedOcc 0
11 mol 60 unq 0 iso 0 dist 9.54864 8.4928 10.5228 5.09908 11.9912 9.96399 numMergedOcc 0
12 mol 60 unq 1 iso 0 dist 9.54864 8.4928 10.5228 10.0675 13.4395 7.55695 numMergedOcc 0
13 mol 60 unq 2 iso 0 dist 9.54864 8.4928 10.5228 14.3334 15.7663 8.82176 numMergedOcc 0
14 mol 73 unq 0 iso 0 dist 9.27331 8.91206 6.28525 12.3394 9.02288 8.03303 numMergedOcc 0
15 mol 73 unq 1 iso 0 dist 6.328 8.67513 5.9876 14.4506 12.6321 8.03303 numMergedOcc 0
16 mol 100 unq 0 iso 0 dist 6.60356 6.14415 6.04919 6.89762 11.5472 7.12017 numMergedOcc 0
17 mol 112 unq 0 iso 0 dist 7.02969 7.35503 7.99528 10.0299 14.3405 7.23962 numMergedOcc 0
18 mol 112 unq 1 iso 0 dist 7.02969 7.35503 7.99528 9.13496 13.1901 9.00067 numMergedOcc 0
19 mol 112 unq 2 iso 0 dist 7.02969 7.35503 7.99528 10.1793 11.3604 9.89499 numMergedOcc 0
20 mol 112 unq 3 iso 0 dist 7.02969 7.35503 7.99528 11.5698 13.2326 7.30204 numMergedOcc 0
21 mol 112 unq 4 iso 0 dist 7.02265 8.79543 7.99528 11.7503 14.3405 7.23962 numMergedOcc 0
22 mol 112 unq 5 iso 0 dist 7.02265 8.79543 7.99528 8.0952 13.1901 9.00067 numMergedOcc 0
23 mol 112 unq 6 iso 0 dist 7.02265 8.79543 7.99528 7.12714 11.3604 9.89499 numMergedOcc 0
24 mol 112 unq 7 iso 0 dist 7.02265 8.79543 7.99528 10.886 13.2326 7.30204 numMergedOcc 0
25 mol 112 unq 8 iso 0 dist 9.42175 6.48223 7.99528 10.626 14.3405 7.23962 numMergedOcc 0
26 mol 112 unq 9 iso 0 dist 9.42175 6.48223 7.99528 8.19562 13.1901 9.00067 numMergedOcc 0
27 mol 112 unq 10 iso 0 dist 9.42175 6.48223 7.99528 5.71097 11.3604 9.89499 numMergedOcc 0
28 mol 112 unq 11 iso 0 dist 9.42175 6.48223 7.99528 5.27363 13.2326 7.30204 numMergedOcc 0
29 mol 114 unq 0 iso 0 dist 5.31281 7.73842 10.9798 5.24877 8.42445 6.34525 numMergedOcc 0
30 mol 114 unq 1 iso 0 dist 8.9922 7.73842 15.009 5.24877 10.2889 6.34525 numMergedOcc 0
31 mol 130 unq 0 iso 0 dist 7.9663 4.85559 4.79695 7.09664 12.0527 8.33077 numMergedOcc 0
32 mol 130 unq 1 iso 0 dist 6.54338 6.87562 4.79695 9.03539 12.0527 8.33077 numMergedOcc 0
33 mol 130 unq 2 iso 0 dist 9.39135 6.87562 8.11667 9.03539 15.8249 8.33077 numMergedOcc 0
34 mol 152 unq 0 iso 0 dist 7.71277 9.19078 10.4193 7.17016 8.89982 9.77552 numMergedOcc 0
35 mol 152 unq 1 iso 0 dist 7.71277 9.19078 10.4193 11.3742 14.5119 8.28642 numMergedOcc 0
36 mol 183 unq 0 iso 0 dist 7.94469 6.40448 4.18413 5.72 10.4467 8.54827 numMergedOcc 0
37 mol 186 unq 0 iso 0 dist 9.45817 4.97005 10.763 11.3961 17.5534 9.56197 numMergedOcc 0
38 mol 186 unq 1 iso 0 dist 9.45817 4.97005 10.763 10.0248 17.9229 7.24795 numMergedOcc 0
39 mol 186 unq 2 iso 0 dist 9.45817 4.97005 10.763 9.14781 10.9329 8.64409 numMergedOcc 0
40 mol 186 unq 3 iso 0 dist 9.45817 4.97005 10.763 6.69897 14.1784 7.60202 numMergedOcc 0
41 mol 186 unq 4 iso 0 dist 9.08767 5.67811 8.32573 9.13357 15.4669 7.28841 numMergedOcc 0
42 mol 188 unq 0 iso 0 dist 9.98092 8.8513 7.16694 7.63908 14.0931 8.47347 numMergedOcc 0
43 mol 207 unq 0 iso 0 dist 8.84785 9.22778 11.2432 7.53149 13.6848 8.32218 numMergedOcc 0
44 mol 207 unq 1 iso 0 dist 8.84785 9.22778 11.2432 15.6632 19.051 7.96797 numMergedOcc 0
45 mol 251 unq 0 iso 0 dist 8.65339 5.0953 4.20853 5.6933 12.2132 8.01198 numMergedOcc 0
46 mol 266 unq 0 iso 0 dist 8.61786 9.98606 11.1063 6.01492 12.1634 7.71657 numMergedOcc 0
47 mol 266 unq 1 iso 0 dist 8.42706 9.98606 17.6604 6.01492 14.2643 7.71657 numMergedOcc 0
48 mol 272 unq 0 iso 0 dist 7.50321 7.11691 9.0626 11.9042 16.9946 9.64269 numMergedOcc 0
49 mol 272 unq 1 iso 0 dist 7.50321 7.11691 9.0626 9.87214 15.1136 6.88809 numMergedOcc 0
50 mol 272 unq 2 iso 0 dist 7.50321 7.11691 9.0626 5.27123 12.4617 8.46061 numMergedOcc 0
51 mol 272 unq 3 iso 0 dist 9.61597 7.11691 8.41005 11.9042 15.2989 9.64269 numMergedOcc 0
52 mol 272 unq 4 iso 0 dist 9.61597 7.11691 8.41005 9.87214 14.9711 6.88809 numMergedOcc 0
53 mol 272 unq 5 iso 0 dist 9.61597 7.11691 8.41005 5.27123 13.2205 8.46061 numMergedOcc 0
54 mol 274 unq 0 iso 0 dist 6.12202 9.4626 7.47773 7.23876 9.02749 7.52109 numMergedOcc 0
55 mol 282 unq 0 iso 0 dist 8.61456 6.91282 6.85098 11.0508 14.0198 8.0241 numMergedOcc 0
56 mol 282 unq 1 iso 0 dist 8.41041 5.51953 6.85098 7.1564 14.0198 8.0241 numMergedOcc 0
57 mol 285 unq 0 iso 0 dist 8.63954 7.06878 11.6511 5.93692 13.8061 5.31728 numMergedOcc 0
58 mol 285 unq 1 iso 0 dist 4.74716 7.06878 6.93502 5.93692 8.71213 5.31728 numMergedOcc 0
