0 mol 0 unq 0 iso 0 dist 7.92645 4.60142 9.46626 9.77143 9.47341 8.32195 numMergedOcc 0
1 mol 1 unq 0 iso 0 dist 8.40848 6.03793 7.90928 12.4968 9.99706 9.44115 numMergedOcc 0
2 mol 6 unq 0 iso 0 dist 8.01937 9.02786 8.06002 16.7824 14.0125 7.78618 numMergedOcc 0
3 mol 37 unq 0 iso 0 dist 7.489 7.01354 6.69711 16.0967 13.27 9.30041 numMergedOcc 0
4 mol 37 unq 1 iso 0 dist 7.77333 5.66124 9.30041 11.873 13.27 6.69711 numMergedOcc 0
5 mol 44 unq 0 iso 0 dist 9.16551 8.39078 9.4798 12.2785 6.85995 7.23261 numMergedOcc 0
6 mol 44 unq 1 iso 0 dist 9.16551 8.39078 9.4798 9.88278 4.19085 8.96501 numMergedOcc 0
7 mol 55 unq 0 iso 0 dist 8.61209 9.93079 9.12204 10.2973 5.41839 9.64783 numMergedOcc 0
8 mol 55 unq 1 iso 0 dist 5.7638 5.14336 9.12204 8.55679 5.41839 9.64783 numMergedOcc 0
9 mol 55 unq 2 iso 0 dist 8.55679 5.14336 9.64783 5.7638 5.41839 9.12204 numMergedOcc 0
10 mol 67 unq 0 iso 0 dist 5.16558 4.39526 5.70192 9.62459 5.32316 7.65646 numMergedOcc 0
11 mol 67 unq 1 iso 0 dist 9.62459 4.39526 7.65646 5.16558 5.32316 5.70192 numMergedOcc 0
12 mol 155 unq 0 iso 0 dist 9.72877 9.22235 8.77391 15.707 9.95765 8.02593 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 8.63713 9.09192 9.20477 13.6065 7.37799 8.45395 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 8.63713 9.09192 9.20477 11.4115 5.54834 9.15368 numMergedOcc 0
15 mol 181 unq 2 iso 0 dist 8.63713 12.1848 7.90237 13.6065 7.37799 5.41368 numMergedOcc 0
16 mol 181 unq 3 iso 0 dist 8.63713 12.1848 7.90237 11.4115 5.54834 7.96182 numMergedOcc 0
17 mol 181 unq 4 iso 0 dist 5.08796 4.56814 6.17129 5.93515 6.7732 5.83596 numMergedOcc 0
18 mol 181 unq 5 iso 0 dist 5.93515 4.56814 5.83596 5.08796 6.7732 6.17129 numMergedOcc 0
19 mol 183 unq 0 iso 0 dist 8.53483 6.93732 7.42108 14.3216 9.96454 9.19941 numMergedOcc 0
20 mol 183 unq 1 iso 0 dist 8.58404 12.0539 7.42108 18.032 9.96454 9.19941 numMergedOcc 0
21 mol 183 unq 2 iso 0 dist 8.50695 4.50779 9.19941 9.74836 9.96454 7.42108 numMergedOcc 0
22 mol 197 unq 0 iso 0 dist 8.61953 7.69844 8.32685 7.91999 5.3979 6.74777 numMergedOcc 0
23 mol 197 unq 1 iso 0 dist 8.61953 7.69844 8.32685 11.8525 9.51831 9.62514 numMergedOcc 0
24 mol 197 unq 2 iso 0 dist 7.91999 7.69844 6.74777 8.61953 5.3979 8.32685 numMergedOcc 0
25 mol 197 unq 3 iso 0 dist 7.91999 7.69844 6.74777 11.8525 4.66266 9.62514 numMergedOcc 0
26 mol 243 unq 0 iso 0 dist 8.93292 6.01814 8.53888 12.5917 6.68091 9.46855 numMergedOcc 0
27 mol 247 unq 0 iso 0 dist 8.72346 15.6015 9.76925 23.1101 18.3145 9.6455 numMergedOcc 0
28 mol 247 unq 1 iso 0 dist 7.39069 14.0393 9.76925 20.3013 18.3145 9.6455 numMergedOcc 0
29 mol 269 unq 0 iso 0 dist 9.48928 6.45659 9.78238 11.6253 9.73015 5.98602 numMergedOcc 0
30 mol 294 unq 0 iso 0 dist 8.74181 4.83248 7.12793 8.96987 6.19256 6.21208 numMergedOcc 0
31 mol 294 unq 1 iso 0 dist 8.96987 4.83248 6.21208 8.74181 6.19256 7.12793 numMergedOcc 0
