0 mol 61 unq 0 iso 0 dist 5.97418 9.33927 9.12873 9.43734 7.93498 3.30756 numMergedOcc 0
1 mol 95 unq 0 iso 0 dist 9.07757 10.1228 9.47394 8.02524 7.27275 5.00693 numMergedOcc 0
2 mol 104 unq 0 iso 0 dist 8.44593 9.22115 7.15143 9.01125 9.43136 4.07581 numMergedOcc 0
3 mol 123 unq 0 iso 0 dist 7.76707 4.6327 7.99359 4.48885 8.40918 7.21006 numMergedOcc 0
4 mol 123 unq 1 iso 0 dist 7.63425 6.12041 7.99359 9.67707 8.40918 7.21006 numMergedOcc 0
5 mol 131 unq 0 iso 0 dist 8.95717 7.19035 8.89564 4.51272 7.75833 5.906 numMergedOcc 0
6 mol 136 unq 0 iso 0 dist 8.06032 7.19078 5.00698 6.13696 9.71312 11.5769 numMergedOcc 0
7 mol 158 unq 0 iso 0 dist 6.45502 10.9769 8.6903 13.3796 9.27714 5.94889 numMergedOcc 0
8 mol 158 unq 1 iso 0 dist 8.66056 11.0962 8.6903 10.7405 9.27714 5.94889 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 6.6514 6.25478 7.04009 4.0116 8.43955 3.85621 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 9.0757 10.3615 8.11014 13.3585 8.5544 8.24104 numMergedOcc 0
11 mol 184 unq 1 iso 0 dist 9.39563 11.4233 8.11014 13.6612 8.5544 8.24104 numMergedOcc 0
12 mol 184 unq 2 iso 0 dist 7.51045 4.96558 8.11014 9.09295 8.5544 8.24104 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 8.98221 5.29106 8.72113 8.57203 5.97886 4.90099 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 5.99974 10.3962 8.43359 10.4305 5.5223 9.77872 numMergedOcc 0
15 mol 192 unq 1 iso 0 dist 5.99974 10.3962 8.43359 13.2584 8.00501 8.01902 numMergedOcc 0
16 mol 193 unq 0 iso 0 dist 8.51497 9.50163 8.30095 13.6567 9.13587 5.57164 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 7.5696 6.67496 7.30459 13.4035 8.77524 8.62729 numMergedOcc 0
18 mol 204 unq 1 iso 0 dist 7.5696 6.81615 8.73423 13.4035 8.77524 16.3802 numMergedOcc 0
19 mol 204 unq 2 iso 0 dist 9.3369 4.7869 6.97502 5.77393 9.26192 3.88406 numMergedOcc 0
20 mol 204 unq 3 iso 0 dist 9.3369 16.4963 8.8078 5.77393 9.26192 15.2302 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 7.19924 9.3643 6.17408 12.6063 8.99104 3.65952 numMergedOcc 0
22 mol 239 unq 1 iso 0 dist 7.19924 9.47569 6.17602 12.6063 8.99104 7.05149 numMergedOcc 0
23 mol 246 unq 0 iso 0 dist 4.7583 4.96684 8.94816 4.3708 9.03834 4.83796 numMergedOcc 0
24 mol 252 unq 0 iso 0 dist 9.31855 12.2252 8.85493 11.2225 9.09279 14.3597 numMergedOcc 0
25 mol 253 unq 0 iso 0 dist 8.27377 9.97671 8.2681 7.82922 6.74521 6.93425 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 9.11602 9.45859 7.64715 4.73745 9.77996 8.64531 numMergedOcc 0
27 mol 287 unq 1 iso 0 dist 9.11602 9.45859 7.64715 4.16431 6.61308 5.37977 numMergedOcc 0
28 mol 287 unq 2 iso 0 dist 9.11602 9.45859 7.64715 10.3443 6.25845 4.53368 numMergedOcc 0
29 mol 287 unq 3 iso 0 dist 9.11602 14.2612 8.50508 4.73745 9.77996 14.5036 numMergedOcc 0
30 mol 287 unq 4 iso 0 dist 9.11602 14.2612 8.50508 4.16431 6.61308 10.4837 numMergedOcc 0
31 mol 287 unq 5 iso 0 dist 9.11602 14.2612 8.50508 10.3443 6.25845 4.12505 numMergedOcc 0
32 mol 288 unq 0 iso 0 dist 9.11602 9.45859 7.64715 4.73745 9.77996 8.64531 numMergedOcc 0
33 mol 288 unq 1 iso 0 dist 9.11602 9.45859 7.64715 4.16431 6.61308 5.37977 numMergedOcc 0
34 mol 288 unq 2 iso 0 dist 9.11602 9.45859 7.64715 10.3443 6.25845 4.53368 numMergedOcc 0
35 mol 288 unq 3 iso 0 dist 9.11602 14.2612 8.50508 4.73745 9.77996 14.5036 numMergedOcc 0
36 mol 288 unq 4 iso 0 dist 9.11602 14.2612 8.50508 4.16431 6.61308 10.4837 numMergedOcc 0
37 mol 288 unq 5 iso 0 dist 9.11602 14.2612 8.50508 10.3443 6.25845 4.12505 numMergedOcc 0
38 mol 289 unq 0 iso 0 dist 9.11602 9.45859 7.64715 4.73745 9.77996 8.64531 numMergedOcc 0
39 mol 289 unq 1 iso 0 dist 9.11602 9.45859 7.64715 4.16431 6.61308 5.37977 numMergedOcc 0
40 mol 289 unq 2 iso 0 dist 9.11602 9.45859 7.64715 10.3443 6.25845 4.53368 numMergedOcc 0
41 mol 289 unq 3 iso 0 dist 9.11602 14.2612 8.50508 4.73745 9.77996 14.5036 numMergedOcc 0
42 mol 289 unq 4 iso 0 dist 9.11602 14.2612 8.50508 4.16431 6.61308 10.4837 numMergedOcc 0
43 mol 289 unq 5 iso 0 dist 9.11602 14.2612 8.50508 10.3443 6.25845 4.12505 numMergedOcc 0
44 mol 291 unq 0 iso 0 dist 8.61441 7.40794 6.53337 4.90012 6.76488 3.27328 numMergedOcc 0
