0 mol 10 unq 0 iso 0 dist 9.31452 5.94361 5.99743 3.5691 8.98746 7.60549 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 7.43758 4.141 9.86409 5.35996 5.75809 7.57437 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 7.6082 4.71264 6.67704 3.82644 6.93709 3.28726 numMergedOcc 0
3 mol 32 unq 1 iso 0 dist 4.09276 4.71264 6.67079 3.82644 6.38271 3.28726 numMergedOcc 0
4 mol 32 unq 2 iso 0 dist 9.24687 8.5755 6.67704 7.47409 6.93709 3.28726 numMergedOcc 0
5 mol 34 unq 0 iso 0 dist 5.68877 9.52807 8.71284 5.22301 9.36493 7.83556 numMergedOcc 0
6 mol 34 unq 1 iso 0 dist 5.68877 9.52807 8.71284 9.36704 9.0665 6.59793 numMergedOcc 0
7 mol 34 unq 2 iso 0 dist 5.68877 9.52807 8.71284 12.1168 7.07773 9.10687 numMergedOcc 0
8 mol 44 unq 0 iso 0 dist 7.41011 10.0797 5.81645 3.76713 9.80946 12.6428 numMergedOcc 0
9 mol 44 unq 1 iso 0 dist 7.41011 6.29545 6.75026 3.76713 9.80946 8.28169 numMergedOcc 0
10 mol 54 unq 0 iso 0 dist 8.34361 14.9943 9.57335 2.97898 9.63616 17.4558 numMergedOcc 0
11 mol 54 unq 1 iso 0 dist 8.34361 11.5332 8.60653 2.97898 9.63616 14.2852 numMergedOcc 0
12 mol 79 unq 0 iso 0 dist 6.96066 4.22631 4.3247 5.73969 4.5892 5.88927 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 8.04448 17.0849 9.40173 9.39313 5.24616 10.256 numMergedOcc 0
14 mol 130 unq 0 iso 0 dist 4.69926 6.84415 6.87196 8.8615 8.12319 3.88766 numMergedOcc 0
15 mol 131 unq 0 iso 0 dist 7.46875 4.34786 5.43662 3.97269 8.44004 5.92118 numMergedOcc 0
16 mol 154 unq 0 iso 0 dist 8.40395 5.80716 5.76862 5.37013 6.1247 4.03185 numMergedOcc 0
17 mol 154 unq 1 iso 0 dist 8.40395 11.2839 5.92763 5.37013 6.1247 9.94519 numMergedOcc 0
18 mol 154 unq 2 iso 0 dist 8.5081 9.10645 5.76862 11.9194 6.1247 4.03185 numMergedOcc 0
19 mol 154 unq 3 iso 0 dist 8.5081 4.02111 5.92763 11.9194 6.1247 9.94519 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 9.14877 6.78739 5.25309 8.75517 8.07518 3.67187 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 9.14877 6.78739 5.25309 3.59953 7.39733 3.63671 numMergedOcc 0
22 mol 185 unq 0 iso 0 dist 7.18997 6.26644 8.7695 3.82689 7.35584 9.87079 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 8.54588 4.29967 7.59836 15.1218 9.08818 11.9472 numMergedOcc 0
24 mol 186 unq 1 iso 0 dist 8.54588 4.29967 7.59836 4.77079 7.93563 3.74763 numMergedOcc 0
25 mol 186 unq 2 iso 0 dist 8.54588 4.29967 7.59836 7.71219 5.70056 4.4787 numMergedOcc 0
26 mol 186 unq 3 iso 0 dist 8.54588 6.48822 9.94274 15.1218 9.08818 14.7313 numMergedOcc 0
27 mol 186 unq 4 iso 0 dist 8.54588 6.48822 9.94274 4.77079 7.93563 4.87674 numMergedOcc 0
28 mol 186 unq 5 iso 0 dist 8.54588 6.48822 9.94274 7.71219 5.70056 8.72129 numMergedOcc 0
29 mol 220 unq 0 iso 0 dist 6.64341 4.37504 8.06003 8.85684 5.04072 8.44353 numMergedOcc 0
30 mol 220 unq 1 iso 0 dist 6.64341 4.37504 8.06003 6.43635 8.67956 3.95528 numMergedOcc 0
31 mol 220 unq 2 iso 0 dist 7.31315 5.69801 8.06003 7.67001 5.04072 8.44353 numMergedOcc 0
32 mol 220 unq 3 iso 0 dist 7.31315 5.69801 8.06003 9.04953 8.67956 3.95528 numMergedOcc 0
33 mol 233 unq 0 iso 0 dist 7.44436 4.73615 8.76329 3.4982 5.22629 5.24709 numMergedOcc 0
34 mol 233 unq 1 iso 0 dist 7.44436 7.68189 9.91906 3.4982 5.22629 6.28883 numMergedOcc 0
35 mol 239 unq 0 iso 0 dist 9.87224 5.38925 9.25097 13.7613 7.99963 12.3078 numMergedOcc 0
36 mol 241 unq 0 iso 0 dist 7.30582 10.7816 9.14228 8.48642 9.87415 16.0653 numMergedOcc 0
37 mol 257 unq 0 iso 0 dist 9.27027 12.4553 6.8256 11.7751 8.81508 8.63927 numMergedOcc 0
38 mol 257 unq 1 iso 0 dist 7.87058 3.63342 6.8256 8.91326 8.81508 8.63927 numMergedOcc 0
39 mol 260 unq 0 iso 0 dist 6.23198 5.33186 8.80499 3.43711 4.20369 5.30506 numMergedOcc 0
40 mol 260 unq 1 iso 0 dist 6.23198 5.33186 8.80499 5.84323 6.4165 3.58385 numMergedOcc 0
41 mol 260 unq 2 iso 0 dist 8.82216 6.74187 8.80499 7.63469 4.20369 5.30506 numMergedOcc 0
42 mol 260 unq 3 iso 0 dist 8.82216 6.74187 8.80499 8.31902 6.4165 3.58385 numMergedOcc 0
43 mol 279 unq 0 iso 0 dist 7.35799 8.34527 7.10052 11.2104 5.76793 5.21917 numMergedOcc 0
44 mol 279 unq 1 iso 0 dist 7.35799 8.34527 7.10052 9.14234 7.72276 9.79726 numMergedOcc 0
45 mol 292 unq 0 iso 0 dist 9.2899 7.1944 6.68183 12.2 8.27039 5.06937 numMergedOcc 0
