0 mol 10 unq 0 iso 0 dist 6.18431 9.07726 7.06787 7.60549 6.77807 13.0204 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.85784 9.87996 3.75822 4.11146 9.58192 9.69854 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 5.80953 6.61696 10.7501 9.63925 7.7447 13.302 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 7.58875 9.52749 4.86472 5.82742 8.80645 9.25711 numMergedOcc 0
4 mol 72 unq 1 iso 0 dist 7.58875 6.91169 4.85556 5.82742 8.80645 8.39955 numMergedOcc 0
5 mol 72 unq 2 iso 0 dist 9.52749 7.58875 4.86472 5.82742 9.25711 8.80645 numMergedOcc 0
6 mol 72 unq 3 iso 0 dist 9.52749 6.91169 3.44489 5.82742 9.25711 8.39955 numMergedOcc 0
7 mol 72 unq 4 iso 0 dist 6.91169 7.58875 4.85556 5.82742 8.39955 8.80645 numMergedOcc 0
8 mol 72 unq 5 iso 0 dist 6.91169 9.52749 3.44489 5.82742 8.39955 9.25711 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 9.77084 6.5551 6.48468 5.84075 9.04293 4.78333 numMergedOcc 0
10 mol 79 unq 1 iso 0 dist 6.5551 9.77084 6.48468 5.84075 4.78333 9.04293 numMergedOcc 0
11 mol 79 unq 2 iso 0 dist 6.5551 9.77084 6.48468 5.41884 4.74254 10.8282 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 5.05893 5.71866 3.78063 5.22259 4.29937 3.65628 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 5.05893 5.71866 3.78063 7.66499 5.37869 4.05415 numMergedOcc 0
14 mol 85 unq 2 iso 0 dist 5.71866 5.05893 3.78063 5.22259 3.65628 4.29937 numMergedOcc 0
15 mol 85 unq 3 iso 0 dist 5.71866 5.05893 3.78063 7.66499 4.05415 5.37869 numMergedOcc 0
16 mol 168 unq 0 iso 0 dist 9.85438 9.42807 13.6611 7.27069 7.0961 8.21227 numMergedOcc 0
17 mol 168 unq 1 iso 0 dist 9.85438 9.42807 13.6611 4.51252 8.26768 11.0485 numMergedOcc 0
18 mol 168 unq 2 iso 0 dist 9.42807 9.85438 13.6611 7.27069 8.21227 7.0961 numMergedOcc 0
19 mol 169 unq 0 iso 0 dist 6.0859 6.05009 3.71099 5.68902 9.06172 8.93091 numMergedOcc 0
20 mol 169 unq 1 iso 0 dist 6.05009 6.0859 3.71099 5.68902 8.93091 9.06172 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 6.88127 6.56416 8.40937 13.2309 9.34653 17.2981 numMergedOcc 0
22 mol 194 unq 0 iso 0 dist 4.19371 9.71015 6.41254 3.7326 4.45769 8.99961 numMergedOcc 0
23 mol 194 unq 1 iso 0 dist 4.19371 9.71015 6.41254 7.29209 5.89939 8.18853 numMergedOcc 0
24 mol 194 unq 2 iso 0 dist 9.71015 4.19371 6.41254 3.7326 8.99961 4.45769 numMergedOcc 0
25 mol 194 unq 3 iso 0 dist 9.71015 4.19371 6.41254 7.29209 8.18853 5.89939 numMergedOcc 0
26 mol 214 unq 0 iso 0 dist 5.31416 5.44533 5.97842 6.28944 9.59928 7.70062 numMergedOcc 0
27 mol 214 unq 1 iso 0 dist 5.44533 5.31416 5.97842 6.28944 7.70062 9.59928 numMergedOcc 0
28 mol 214 unq 2 iso 0 dist 5.44533 5.31416 5.97842 7.23583 7.66702 11.1063 numMergedOcc 0
29 mol 222 unq 0 iso 0 dist 8.43195 8.23406 3.58181 3.98604 8.88902 9.83916 numMergedOcc 0
30 mol 224 unq 0 iso 0 dist 9.46687 9.25617 17.5293 9.61316 7.98132 13.3017 numMergedOcc 0
31 mol 224 unq 1 iso 0 dist 9.46687 9.25617 17.5293 8.81276 7.99036 13.5562 numMergedOcc 0
32 mol 260 unq 0 iso 0 dist 6.75725 9.31888 14.374 3.60349 8.51564 11.5762 numMergedOcc 0
33 mol 260 unq 1 iso 0 dist 9.31888 6.75725 14.374 7.28821 7.49606 11.8771 numMergedOcc 0
