0 mol 20 unq 0 iso 0 dist 4.90613 9.14371 10.9288 7.89835 10.452 4.95725 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 4.90613 9.14371 10.9288 9.94205 13.3417 5.84217 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 4.90613 9.14371 10.9288 9.08453 12.4239 4.18921 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 9.97806 8.13365 12.1157 6.77987 3.9893 10.2876 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 6.32779 8.13365 5.92191 6.77987 5.15319 10.2876 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 9.33902 6.80849 4.42703 6.74914 6.01288 4.79736 numMergedOcc 0
6 mol 51 unq 0 iso 0 dist 8.58008 8.99612 8.3248 9.07954 4.48708 4.32726 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 6.84323 9.27092 4.44795 8.09973 5.90259 5.68906 numMergedOcc 0
8 mol 62 unq 1 iso 0 dist 7.24768 9.27092 4.83921 8.09973 6.38075 5.68906 numMergedOcc 0
9 mol 62 unq 2 iso 0 dist 8.51622 9.27092 6.16158 8.09973 10.3714 5.68906 numMergedOcc 0
10 mol 91 unq 0 iso 0 dist 8.42914 8.00525 7.45926 6.64714 8.88262 12.6799 numMergedOcc 0
11 mol 91 unq 1 iso 0 dist 8.17327 8.00525 5.55005 6.64714 11.1951 12.6799 numMergedOcc 0
12 mol 91 unq 2 iso 0 dist 9.52936 6.91417 14.5145 8.72835 17.5103 9.48557 numMergedOcc 0
13 mol 91 unq 3 iso 0 dist 9.52936 8.00525 9.57561 6.64714 10.5022 12.6799 numMergedOcc 0
14 mol 93 unq 0 iso 0 dist 5.27541 9.10877 6.09816 9.43355 8.99253 10.8106 numMergedOcc 0
15 mol 93 unq 1 iso 0 dist 5.27541 9.10877 6.09816 5.64141 3.78587 7.14217 numMergedOcc 0
16 mol 93 unq 2 iso 0 dist 5.27541 9.10877 6.09816 5.46186 10.5386 12.9351 numMergedOcc 0
17 mol 95 unq 0 iso 0 dist 6.4081 8.27456 11.9095 8.0675 9.97278 3.94537 numMergedOcc 0
18 mol 140 unq 0 iso 0 dist 8.312 7.81701 8.25136 9.62309 9.3466 4.91618 numMergedOcc 0
19 mol 178 unq 0 iso 0 dist 7.55683 7.14849 4.51874 5.4647 4.00111 6.42973 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 5.52744 8.84116 9.06308 9.22792 11.7817 12.9384 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 5.52744 8.84116 9.06308 7.85696 8.23538 9.34394 numMergedOcc 0
22 mol 186 unq 2 iso 0 dist 5.52744 8.84116 9.06308 5.00402 5.74741 9.61375 numMergedOcc 0
23 mol 186 unq 3 iso 0 dist 5.52744 8.84116 9.06308 6.17773 3.88002 6.03488 numMergedOcc 0
24 mol 186 unq 4 iso 0 dist 5.52744 8.16369 11.7317 9.22792 11.7817 13.6489 numMergedOcc 0
25 mol 186 unq 5 iso 0 dist 5.52744 8.16369 11.7317 7.85696 8.23538 12.4503 numMergedOcc 0
26 mol 186 unq 6 iso 0 dist 5.52744 8.16369 11.7317 5.00402 5.74741 11.5563 numMergedOcc 0
27 mol 186 unq 7 iso 0 dist 5.52744 8.16369 11.7317 6.17773 3.88002 10.3727 numMergedOcc 0
28 mol 196 unq 0 iso 0 dist 9.67795 4.97115 6.94473 4.48862 10.2981 4.53084 numMergedOcc 0
29 mol 196 unq 1 iso 0 dist 9.67795 9.45804 8.09841 4.48862 10.2981 11.522 numMergedOcc 0
30 mol 196 unq 2 iso 0 dist 9.67795 9.8486 14.1935 4.48862 10.2981 13.0429 numMergedOcc 0
31 mol 196 unq 3 iso 0 dist 9.67795 7.23126 12.8012 4.48862 10.2981 11.5807 numMergedOcc 0
32 mol 204 unq 0 iso 0 dist 9.06541 5.5581 10.4409 9.04035 9.72425 11.3125 numMergedOcc 0
