0 mol 4 unq 0 iso 0 dist 6.12485 9.04027 9.77707 5.52224 8.81559 14.3367 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 8.01055 8.61976 4.35219 11.69 6.8848 11.2222 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 8.03458 8.2106 10.4382 6.61479 9.88507 11.5496 numMergedOcc 0
3 mol 33 unq 0 iso 0 dist 7.44828 8.04019 14.7604 13.6327 9.8482 21.5255 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 9.40644 5.35252 5.43494 11.0398 7.66163 9.48288 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 5.35252 9.40644 5.43494 11.0398 9.48288 7.66163 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 8.52643 9.75299 4.78627 12.0216 5.94373 9.97062 numMergedOcc 0
7 mol 64 unq 1 iso 0 dist 5.41357 9.30042 4.78627 7.07433 5.94373 9.97062 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 7.58027 4.34694 3.73929 10.9054 7.546 7.20403 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 4.34694 7.58027 3.73929 10.9054 7.20403 7.546 numMergedOcc 0
10 mol 103 unq 0 iso 0 dist 6.56481 8.078 11.6637 9.47975 9.50699 17.5416 numMergedOcc 0
11 mol 116 unq 0 iso 0 dist 6.53824 6.61973 4.48374 10.4136 8.3971 6.74026 numMergedOcc 0
12 mol 116 unq 1 iso 0 dist 6.61973 6.53824 4.48374 10.4136 6.74026 8.3971 numMergedOcc 0
13 mol 140 unq 0 iso 0 dist 7.77669 9.67726 4.18932 5.62785 9.04575 10.4639 numMergedOcc 0
14 mol 174 unq 0 iso 0 dist 8.16228 8.57467 5.33032 6.97204 8.39178 12.2017 numMergedOcc 0
15 mol 174 unq 1 iso 0 dist 8.16228 8.57467 5.33032 9.84841 7.54918 12.5389 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 9.40718 8.92801 12.0946 14.1039 9.2933 14.4508 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 9.40718 8.92801 12.0946 5.39949 8.77781 8.70756 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 6.72718 8.72949 10.4327 14.2953 8.91143 17.0271 numMergedOcc 0
19 mol 192 unq 0 iso 0 dist 6.2016 8.3453 6.63296 8.67274 8.29166 11.9238 numMergedOcc 0
20 mol 192 unq 1 iso 0 dist 6.2016 8.3453 6.63296 13.2917 8.14859 13.4317 numMergedOcc 0
21 mol 192 unq 2 iso 0 dist 6.2016 8.3453 6.63296 10.3343 5.62421 12 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 5.86911 7.89258 5.68826 5.74127 5.82124 8.31236 numMergedOcc 0
23 mol 214 unq 1 iso 0 dist 7.89258 5.86911 5.68826 5.74127 8.31236 5.82124 numMergedOcc 0
24 mol 229 unq 0 iso 0 dist 6.28935 8.4208 5.50813 4.65019 8.70049 9.55385 numMergedOcc 0
25 mol 229 unq 1 iso 0 dist 8.4208 6.28935 5.50813 4.65019 9.55385 8.70049 numMergedOcc 0
26 mol 239 unq 0 iso 0 dist 8.86185 9.01071 15.9311 5.86546 8.87182 14.3757 numMergedOcc 0
27 mol 239 unq 1 iso 0 dist 8.86185 9.01071 15.9311 8.35939 5.95622 13.4934 numMergedOcc 0
28 mol 249 unq 0 iso 0 dist 8.00386 3.67935 6.79958 11.2425 9.58168 11.909 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 8.57274 9.48772 10.4538 12.3617 7.87648 15.4625 numMergedOcc 0
30 mol 258 unq 1 iso 0 dist 8.57274 5.53369 6.94631 12.3617 7.87648 13.7641 numMergedOcc 0
31 mol 266 unq 0 iso 0 dist 9.0836 9.62494 5.40028 8.25534 9.34312 12.6809 numMergedOcc 0
32 mol 273 unq 0 iso 0 dist 5.78262 7.6489 8.60201 7.10817 9.16554 14.4972 numMergedOcc 0
33 mol 273 unq 1 iso 0 dist 5.78262 7.6489 8.60201 4.30863 8.83491 9.02711 numMergedOcc 0
34 mol 273 unq 2 iso 0 dist 7.6489 5.78262 8.60201 4.30863 9.02711 8.83491 numMergedOcc 0
35 mol 281 unq 0 iso 0 dist 4.75349 8.94206 8.81755 6.79166 7.85707 13.8853 numMergedOcc 0
