0 mol 21 unq 0 iso 0 dist 8.7443 14.2035 9.35064 9.09983 9.08579 10.0318 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 9.72036 6.66552 7.80117 4.45291 8.25915 6.82158 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 9.72036 14.2962 9.79386 4.45291 8.25915 12.8294 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 7.0851 5.88248 7.47596 11.5886 9.78501 6.33193 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 9.07283 11.6226 7.32699 5.24524 9.77004 14.0438 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 9.07283 6.87877 6.45933 5.24524 9.77004 10.6879 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 9.27814 11.0215 6.2753 15.4847 9.22903 4.47873 numMergedOcc 0
7 mol 90 unq 0 iso 0 dist 6.77993 5.22926 8.96446 4.98478 9.47481 9.58856 numMergedOcc 0
8 mol 111 unq 0 iso 0 dist 6.33923 9.73916 8.69371 4.53184 7.36025 13.0386 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 8.14978 7.47861 4.93944 13.0903 9.80185 13.1656 numMergedOcc 0
10 mol 165 unq 0 iso 0 dist 7.84854 4.69546 7.55302 5.05659 4.63353 6.28125 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.00382 5.43796 8.45086 4.18399 8.51947 4.32169 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 8.78251 14.813 7.62945 12.2153 7.005 4.29134 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 4.42095 7.59741 7.31316 13.9253 9.60788 14.5547 numMergedOcc 0
14 mol 194 unq 1 iso 0 dist 4.42095 12.4055 8.9865 13.9253 9.60788 5.25176 numMergedOcc 0
15 mol 194 unq 2 iso 0 dist 4.63898 11.577 7.31316 10.4232 9.60788 14.5547 numMergedOcc 0
16 mol 194 unq 3 iso 0 dist 4.63898 7.3101 8.9865 10.4232 9.60788 5.25176 numMergedOcc 0
17 mol 194 unq 4 iso 0 dist 9.53641 7.22039 7.31316 14.7844 9.60788 14.5547 numMergedOcc 0
18 mol 194 unq 5 iso 0 dist 9.53641 15.217 8.9865 14.7844 9.60788 5.25176 numMergedOcc 0
19 mol 225 unq 0 iso 0 dist 8.52735 12.0772 8.92555 8.16509 8.13294 5.29135 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 7.45508 4.30527 7.14918 11.0598 7.01673 8.65126 numMergedOcc 0
21 mol 243 unq 0 iso 0 dist 7.39884 6.58738 7.6142 7.62457 9.7465 5.15447 numMergedOcc 0
22 mol 252 unq 0 iso 0 dist 5.2116 9.93257 7.38867 6.46939 6.71152 5.56789 numMergedOcc 0
23 mol 254 unq 0 iso 0 dist 7.94753 7.0041 8.87934 13.5342 9.70628 13.6734 numMergedOcc 0
24 mol 254 unq 1 iso 0 dist 7.94753 13.0274 9.47133 13.5342 9.70628 7.62172 numMergedOcc 0
25 mol 254 unq 2 iso 0 dist 9.99046 7.0041 9.66687 13.5342 7.98511 13.6734 numMergedOcc 0
26 mol 254 unq 3 iso 0 dist 9.99046 13.0274 7.61537 13.5342 7.98511 7.62172 numMergedOcc 0
27 mol 274 unq 0 iso 0 dist 6.32853 8.60551 7.70811 5.69575 8.23254 4.74285 numMergedOcc 0
28 mol 274 unq 1 iso 0 dist 6.32853 3.93072 9.98144 5.69575 8.23254 6.60935 numMergedOcc 0
29 mol 283 unq 0 iso 0 dist 9.82274 10.9203 9.33601 6.97677 8.91437 5.2842 numMergedOcc 0
30 mol 283 unq 1 iso 0 dist 7.17276 5.72409 9.33601 5.08363 8.91437 5.2842 numMergedOcc 0
