0 mol 21 unq 0 iso 0 dist 8.38921 6.86154 6.08338 5.20061 5.93898 4.28381 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 7.63534 4.35757 8.97793 10.4541 9.85905 9.21694 numMergedOcc 0
2 mol 76 unq 1 iso 0 dist 7.63534 6.55474 8.19682 10.4541 9.85905 4.00608 numMergedOcc 0
3 mol 76 unq 2 iso 0 dist 8.51543 8.36307 6.21982 5.4968 6.72869 4.00608 numMergedOcc 0
4 mol 76 unq 3 iso 0 dist 9.32453 12.9327 9.49449 5.22 9.6952 14.5852 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 8.25679 7.09701 9.10189 5.7326 7.51139 8.40245 numMergedOcc 0
6 mol 89 unq 0 iso 0 dist 5.25504 4.37893 8.75946 5.72671 5.51831 8.44919 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 5.11612 5.39389 7.76729 3.85674 6.24825 5.78043 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 5.22628 9.16391 9.66954 3.82475 6.39384 6.49835 numMergedOcc 0
9 mol 115 unq 2 iso 0 dist 5.22628 5.26498 7.64585 3.82475 6.39384 5.65471 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 8.75736 9.88404 8.94837 14.0091 9.00918 5.58312 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 8.75736 9.88404 8.94837 15.5753 7.99477 9.61537 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 6.76166 6.15672 8.94837 9.88169 9.00918 5.58312 numMergedOcc 0
13 mol 134 unq 3 iso 0 dist 6.76166 6.15672 8.94837 11.8593 7.99477 9.61537 numMergedOcc 0
14 mol 178 unq 0 iso 0 dist 7.14849 8.42124 8.96511 3.95924 9.11204 5.87125 numMergedOcc 0
15 mol 178 unq 1 iso 0 dist 8.63718 8.15374 8.96511 12.5927 9.11204 5.87125 numMergedOcc 0
16 mol 192 unq 0 iso 0 dist 6.44896 6.15396 8.36822 4.77116 9.78634 10.3099 numMergedOcc 0
17 mol 192 unq 1 iso 0 dist 6.44896 6.15396 8.36822 4.65378 5.64942 10.1087 numMergedOcc 0
18 mol 192 unq 2 iso 0 dist 6.44896 6.15396 8.36822 5.48435 7.43054 10.0566 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 6.20646 6.27504 5.90931 6.05253 7.9133 11.2106 numMergedOcc 0
20 mol 204 unq 1 iso 0 dist 6.73266 6.67807 5.90931 13.3588 7.9133 11.2106 numMergedOcc 0
21 mol 213 unq 0 iso 0 dist 7.22234 10.6066 6.0965 12.4111 8.21793 4.31175 numMergedOcc 0
22 mol 213 unq 1 iso 0 dist 7.22234 15.6607 9.59129 12.4111 8.21793 4.89372 numMergedOcc 0
23 mol 213 unq 2 iso 0 dist 5.86501 5.56276 6.0965 6.09933 8.21793 4.31175 numMergedOcc 0
24 mol 213 unq 3 iso 0 dist 5.86501 10.1617 9.59129 6.09933 8.21793 4.89372 numMergedOcc 0
25 mol 218 unq 0 iso 0 dist 9.85348 7.64323 8.53199 9.15328 7.33709 11.6662 numMergedOcc 0
26 mol 234 unq 0 iso 0 dist 8.9413 6.40261 9.5707 14.075 7.81215 11.8229 numMergedOcc 0
27 mol 234 unq 1 iso 0 dist 8.9413 4.48571 7.85175 14.075 7.81215 10.5304 numMergedOcc 0
28 mol 234 unq 2 iso 0 dist 4.91961 12.2893 9.5707 4.84686 7.81215 11.8229 numMergedOcc 0
29 mol 234 unq 3 iso 0 dist 4.91961 11.1927 7.85175 4.84686 7.81215 10.5304 numMergedOcc 0
30 mol 234 unq 4 iso 0 dist 7.14333 10.3017 9.39181 4.84686 5.64285 6.45373 numMergedOcc 0
31 mol 235 unq 0 iso 0 dist 8.79626 12.9417 7.32211 9.92254 5.1823 4.47008 numMergedOcc 0
32 mol 235 unq 1 iso 0 dist 8.79626 12.9417 7.32211 5.66713 5.70635 7.34601 numMergedOcc 0
33 mol 236 unq 0 iso 0 dist 5.99137 4.47231 5.34718 13.9834 9.3206 13.0765 numMergedOcc 0
34 mol 241 unq 0 iso 0 dist 6.97756 8.28913 6.83797 4.63415 7.95042 12.0248 numMergedOcc 0
35 mol 257 unq 0 iso 0 dist 8.95261 9.63067 7.14834 3.84196 8.83833 10.0311 numMergedOcc 0
36 mol 257 unq 1 iso 0 dist 7.80336 5.47761 7.14834 5.95711 8.83833 10.0311 numMergedOcc 0
37 mol 259 unq 0 iso 0 dist 6.20344 12.9748 7.48005 10.4532 9.63573 9.98303 numMergedOcc 0
38 mol 259 unq 1 iso 0 dist 6.20344 12.9748 7.48005 5.13757 7.66153 14.0829 numMergedOcc 0
39 mol 277 unq 0 iso 0 dist 9.64889 10.971 9.41725 5.36788 9.35539 7.07508 numMergedOcc 0
40 mol 277 unq 1 iso 0 dist 9.64889 10.971 9.41725 15.23 8.9682 18.3854 numMergedOcc 0
41 mol 277 unq 2 iso 0 dist 9.64889 10.971 9.41725 15.0167 6.92711 16.1088 numMergedOcc 0
42 mol 284 unq 0 iso 0 dist 9.12551 10.7029 4.86729 3.97057 5.83329 7.67245 numMergedOcc 0
43 mol 292 unq 0 iso 0 dist 8.99442 3.91335 9.454 6.17318 9.9182 8.68456 numMergedOcc 0
44 mol 292 unq 1 iso 0 dist 8.99442 3.91335 9.454 4.77323 8.9221 7.29981 numMergedOcc 0
