0 mol 1 unq 0 iso 0 dist 8.40848 6.03793 7.90928 8.27735 6.35409 8.56884 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.07937 17.0437 9.97117 10.6139 5.3315 6.73162 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 6.42206 7.23551 9.97117 7.34549 5.3315 6.73162 numMergedOcc 0
3 mol 26 unq 2 iso 0 dist 9.66602 8.34836 9.97117 9.72289 5.3315 6.73162 numMergedOcc 0
4 mol 99 unq 0 iso 0 dist 7.28774 4.54208 4.74654 11.1067 7.79079 7.72108 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 6.12404 5.26498 5.58063 5.22628 5.24961 7.64585 numMergedOcc 0
6 mol 155 unq 0 iso 0 dist 9.72877 6.85166 7.50392 10.7622 4.94973 9.38946 numMergedOcc 0
7 mol 155 unq 1 iso 0 dist 9.72877 9.22235 8.77391 16.5368 12.7814 7.39644 numMergedOcc 0
8 mol 155 unq 2 iso 0 dist 9.72877 9.22235 8.77391 10.7622 4.94973 7.36102 numMergedOcc 0
9 mol 173 unq 0 iso 0 dist 7.76856 9.00192 9.56248 10.6341 8.11337 7.93331 numMergedOcc 0
10 mol 173 unq 1 iso 0 dist 7.76856 9.00192 9.56248 13.4919 10.8336 6.98095 numMergedOcc 0
11 mol 173 unq 2 iso 0 dist 7.76856 9.00192 9.56248 9.09857 10.6484 8.31897 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 8.63713 9.09192 9.20477 7.15963 4.98009 6.94688 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 8.63713 12.1848 7.90237 7.15963 4.98009 6.71012 numMergedOcc 0
14 mol 181 unq 2 iso 0 dist 5.08796 4.56814 6.17129 6.43406 4.3158 4.93785 numMergedOcc 0
15 mol 181 unq 3 iso 0 dist 5.93515 4.56814 5.83596 6.43406 4.3226 4.93785 numMergedOcc 0
16 mol 183 unq 0 iso 0 dist 8.53483 6.93732 7.42108 11.7243 4.81807 9.93083 numMergedOcc 0
17 mol 183 unq 1 iso 0 dist 8.53483 6.93732 7.42108 9.09322 7.79648 7.01383 numMergedOcc 0
18 mol 183 unq 2 iso 0 dist 8.58404 12.0539 7.42108 13.1323 4.81807 9.93083 numMergedOcc 0
19 mol 183 unq 3 iso 0 dist 8.58404 12.0539 7.42108 15.4744 7.79648 7.01383 numMergedOcc 0
20 mol 183 unq 4 iso 0 dist 8.50695 4.50779 9.19941 11.5806 7.68618 9.93083 numMergedOcc 0
21 mol 183 unq 5 iso 0 dist 8.50695 4.50779 9.19941 9.60723 6.50505 7.01383 numMergedOcc 0
22 mol 197 unq 0 iso 0 dist 8.61953 7.69844 8.32685 9.14737 10.5326 8.99696 numMergedOcc 0
23 mol 197 unq 1 iso 0 dist 7.91999 7.69844 6.74777 9.14737 5.29309 8.99696 numMergedOcc 0
24 mol 236 unq 0 iso 0 dist 4.43243 4.47231 6.98151 11.0371 11.2013 7.17676 numMergedOcc 0
25 mol 236 unq 1 iso 0 dist 4.43243 4.47231 6.98151 5.99137 4.15973 5.34718 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 8.71686 6.28599 8.52504 14.1487 10.5784 8.71415 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 8.92585 6.04481 6.24435 10.9573 6.76977 6.05141 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 8.92585 6.04481 6.24435 10.5699 10.4548 8.09066 numMergedOcc 0
29 mol 238 unq 3 iso 0 dist 8.92585 6.04481 6.24435 6.51823 10.7712 7.2766 numMergedOcc 0
30 mol 243 unq 0 iso 0 dist 8.93292 6.01814 8.53888 13.4752 10.3202 8.61104 numMergedOcc 0
31 mol 247 unq 0 iso 0 dist 8.72346 15.6015 9.76925 21.8264 14.6138 6.6838 numMergedOcc 0
32 mol 247 unq 1 iso 0 dist 7.39069 14.0393 9.76925 16.9466 14.6138 6.6838 numMergedOcc 0
33 mol 294 unq 0 iso 0 dist 8.74181 4.83248 7.12793 11.5042 11.2287 7.34205 numMergedOcc 0
34 mol 294 unq 1 iso 0 dist 8.96987 4.83248 6.21208 11.5042 6.45145 7.34205 numMergedOcc 0
