0 mol 1 unq 0 iso 0 dist 7.21349 7.81034 4.79345 9.19497 3.84685 8.29622 numMergedOcc 0
1 mol 1 unq 0 iso 1 dist 7.21349 9.19497 3.84685 7.81034 4.79345 8.29622 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 9.59131 6.51139 13.4526 6.91278 11.3802 4.67252 numMergedOcc 0
3 mol 41 unq 0 iso 1 dist 9.59131 6.91278 11.3802 6.51139 13.4526 4.67252 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 9.14996 8.18251 3.98752 5.02642 7.08886 5.5471 numMergedOcc 0
5 mol 46 unq 0 iso 1 dist 9.14996 5.02642 7.08886 8.18251 3.98752 5.5471 numMergedOcc 0
6 mol 81 unq 0 iso 0 dist 5.96486 8.9672 4.57548 9.80754 8.00722 12.2639 numMergedOcc 0
7 mol 81 unq 0 iso 1 dist 5.96486 9.80754 8.00722 8.9672 4.57548 12.2639 numMergedOcc 0
8 mol 155 unq 0 iso 0 dist 6.91762 9.25488 9.37545 8.02356 5.49557 4.76912 numMergedOcc 0
9 mol 155 unq 0 iso 1 dist 6.91762 8.02356 5.49557 9.25488 9.37545 4.76912 numMergedOcc 0
10 mol 183 unq 0 iso 0 dist 8.15747 7.58913 8.4495 6.0782 3.94874 5.77399 numMergedOcc 0
11 mol 183 unq 0 iso 1 dist 8.15747 6.0782 3.94874 7.58913 8.4495 5.77399 numMergedOcc 0
12 mol 183 unq 1 iso 0 dist 8.74903 7.58913 5.86369 6.0782 4.44329 5.77399 numMergedOcc 0
13 mol 183 unq 1 iso 1 dist 8.74903 6.0782 4.44329 7.58913 5.86369 5.77399 numMergedOcc 0
14 mol 185 unq 0 iso 0 dist 9.56016 8.85182 4.63469 5.7065 13.6086 11.0431 numMergedOcc 0
15 mol 185 unq 0 iso 1 dist 9.56016 5.7065 13.6086 8.85182 4.63469 11.0431 numMergedOcc 0
16 mol 185 unq 1 iso 0 dist 7.92501 8.85182 9.22587 5.7065 9.4687 11.0431 numMergedOcc 0
17 mol 185 unq 1 iso 1 dist 7.92501 5.7065 9.4687 8.85182 9.22587 11.0431 numMergedOcc 0
18 mol 192 unq 0 iso 0 dist 9.80584 5.21088 8.61606 9.78743 19.1942 11.6247 numMergedOcc 0
19 mol 192 unq 0 iso 1 dist 9.80584 9.78743 19.1942 5.21088 8.61606 11.6247 numMergedOcc 0
20 mol 192 unq 1 iso 0 dist 9.80584 5.21088 8.61606 8.25609 4.97164 8.74203 numMergedOcc 0
21 mol 192 unq 1 iso 1 dist 9.80584 8.25609 4.97164 5.21088 8.61606 8.74203 numMergedOcc 0
22 mol 192 unq 1 iso 0 dist 9.80584 9.78743 19.1942 8.25609 4.97164 17.766 numMergedOcc 0
23 mol 192 unq 1 iso 1 dist 9.80584 8.25609 4.97164 9.78743 19.1942 17.766 numMergedOcc 0
24 mol 192 unq 2 iso 0 dist 7.95713 5.21088 5.41356 9.78743 16.5293 11.6247 numMergedOcc 0
25 mol 192 unq 2 iso 1 dist 7.95713 9.78743 16.5293 5.21088 5.41356 11.6247 numMergedOcc 0
26 mol 192 unq 3 iso 0 dist 7.95713 5.21088 5.41356 8.25609 4.87986 8.74203 numMergedOcc 0
27 mol 192 unq 3 iso 1 dist 7.95713 8.25609 4.87986 5.21088 5.41356 8.74203 numMergedOcc 0
28 mol 192 unq 3 iso 0 dist 7.95713 9.78743 16.5293 8.25609 4.87986 17.766 numMergedOcc 0
29 mol 192 unq 3 iso 1 dist 7.95713 8.25609 4.87986 9.78743 16.5293 17.766 numMergedOcc 0
30 mol 232 unq 0 iso 0 dist 5.29561 9.84479 11.4949 9.82645 11.8349 18.9921 numMergedOcc 0
31 mol 232 unq 0 iso 1 dist 5.29561 9.82645 11.8349 9.84479 11.4949 18.9921 numMergedOcc 0
32 mol 232 unq 1 iso 0 dist 9.16638 9.84479 14.347 9.82645 9.07946 18.9921 numMergedOcc 0
33 mol 232 unq 1 iso 1 dist 9.16638 9.82645 9.07946 9.84479 14.347 18.9921 numMergedOcc 0
34 mol 233 unq 0 iso 0 dist 9.80133 7.20629 6.66728 6.5622 5.24667 5.45848 numMergedOcc 0
35 mol 233 unq 0 iso 1 dist 9.80133 6.5622 5.24667 7.20629 6.66728 5.45848 numMergedOcc 0
36 mol 233 unq 1 iso 0 dist 7.74693 9.44671 11.8011 7.21531 5.89828 10.0812 numMergedOcc 0
37 mol 233 unq 1 iso 1 dist 7.74693 7.21531 5.89828 9.44671 11.8011 10.0812 numMergedOcc 0
38 mol 243 unq 0 iso 0 dist 5.86679 8.6336 6.42012 9.58608 9.76752 15.9267 numMergedOcc 0
39 mol 243 unq 0 iso 1 dist 5.86679 9.58608 9.76752 8.6336 6.42012 15.9267 numMergedOcc 0
40 mol 243 unq 1 iso 0 dist 8.28347 8.6336 12.916 9.58608 4.73439 15.9267 numMergedOcc 0
41 mol 243 unq 1 iso 1 dist 8.28347 9.58608 4.73439 8.6336 12.916 15.9267 numMergedOcc 0
42 mol 258 unq 0 iso 0 dist 9.64278 8.17026 11.7692 8.43002 12.4784 6.94631 numMergedOcc 0
43 mol 258 unq 0 iso 1 dist 9.64278 8.43002 12.4784 8.17026 11.7692 6.94631 numMergedOcc 0
44 mol 287 unq 0 iso 0 dist 9.39409 6.19545 12.2952 7.3388 8.37461 7.97466 numMergedOcc 0
45 mol 287 unq 0 iso 1 dist 9.39409 7.3388 8.37461 6.19545 12.2952 7.97466 numMergedOcc 0
46 mol 287 unq 1 iso 0 dist 9.39409 6.19545 12.2952 6.96248 4.03583 8.60638 numMergedOcc 0
47 mol 287 unq 1 iso 1 dist 9.39409 6.96248 4.03583 6.19545 12.2952 8.60638 numMergedOcc 0
48 mol 287 unq 1 iso 0 dist 9.39409 7.3388 8.37461 6.96248 4.03583 7.11169 numMergedOcc 0
49 mol 287 unq 1 iso 1 dist 9.39409 6.96248 4.03583 7.3388 8.37461 7.11169 numMergedOcc 0
50 mol 288 unq 0 iso 0 dist 9.39409 6.19545 12.2952 7.3388 8.37461 7.97466 numMergedOcc 0
51 mol 288 unq 0 iso 1 dist 9.39409 7.3388 8.37461 6.19545 12.2952 7.97466 numMergedOcc 0
52 mol 288 unq 1 iso 0 dist 9.39409 6.19545 12.2952 6.96248 4.03583 8.60638 numMergedOcc 0
53 mol 288 unq 1 iso 1 dist 9.39409 6.96248 4.03583 6.19545 12.2952 8.60638 numMergedOcc 0
54 mol 288 unq 1 iso 0 dist 9.39409 7.3388 8.37461 6.96248 4.03583 7.11169 numMergedOcc 0
55 mol 288 unq 1 iso 1 dist 9.39409 6.96248 4.03583 7.3388 8.37461 7.11169 numMergedOcc 0
56 mol 289 unq 0 iso 0 dist 9.39409 6.19545 12.2952 7.3388 8.37461 7.97466 numMergedOcc 0
57 mol 289 unq 0 iso 1 dist 9.39409 7.3388 8.37461 6.19545 12.2952 7.97466 numMergedOcc 0
58 mol 289 unq 1 iso 0 dist 9.39409 6.19545 12.2952 6.96248 4.03583 8.60638 numMergedOcc 0
59 mol 289 unq 1 iso 1 dist 9.39409 6.96248 4.03583 6.19545 12.2952 8.60638 numMergedOcc 0
60 mol 289 unq 1 iso 0 dist 9.39409 7.3388 8.37461 6.96248 4.03583 7.11169 numMergedOcc 0
61 mol 289 unq 1 iso 1 dist 9.39409 6.96248 4.03583 7.3388 8.37461 7.11169 numMergedOcc 0
