0 mol 26 unq 0 iso 0 dist 8.6112 7.89667 7.07479 5.3315 10.8071 8.31381 6.88695 4.09495 8.39015 8.34347 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 5.81747 4.90216 4.82623 10.9658 9.00229 8.30217 14.2274 10.1484 9.65136 8.95999 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 6.81975 4.90216 6.24283 10.9658 12.5405 8.30217 14.2274 11.5346 9.65136 8.95999 numMergedOcc 0
3 mol 113 unq 0 iso 0 dist 9.64281 9.86767 3.77247 4.36935 10.783 9.59585 8.89481 14.0364 13.0914 5.86073 numMergedOcc 0
4 mol 113 unq 1 iso 0 dist 9.64281 7.08403 5.96967 14.0364 8.89481 7.02367 10.783 4.36935 5.37655 5.86073 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 8.43293 9.16089 4.74539 5.89379 7.04864 6.42623 12.2464 4.5543 5.6295 8.75408 numMergedOcc 0
6 mol 120 unq 1 iso 0 dist 8.43293 9.16089 4.74539 5.89379 7.04864 6.42623 11.2107 6.81949 3.824 6.44653 numMergedOcc 0
7 mol 120 unq 2 iso 0 dist 8.43293 8.03124 3.71884 6.81949 11.2107 8.38358 7.04864 5.89379 3.35803 6.44653 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 9.0455 7.84813 3.54691 5.56946 9.28278 7.97548 13.5311 14.5776 12.5321 8.54584 numMergedOcc 0
9 mol 129 unq 1 iso 0 dist 9.0455 7.84813 3.54691 6.4379 12.3446 9.9291 13.5311 14.5776 12.5321 8.53613 numMergedOcc 0
10 mol 169 unq 0 iso 0 dist 9.83308 9.58901 3.89732 4.34424 11.0485 9.37946 11.5885 18.7623 17.056 8.49164 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 9.718 9.25184 12.162 3.84723 11.8313 6.85824 8.62103 14.2438 4.29623 6.18308 numMergedOcc 0
12 mol 210 unq 1 iso 0 dist 8.61629 9.25184 9.9492 3.84723 10.4825 6.85824 8.62103 11.4281 4.29623 6.18308 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 8.80167 9.68612 6.62122 5.67031 4.84709 9.06459 10.961 4.55245 4.15355 8.82096 numMergedOcc 0
14 mol 235 unq 0 iso 0 dist 8.92054 8.1174 3.76405 5.23741 9.11256 8.08965 8.48065 6.84447 4.75609 5.4638 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 5.86892 8.71119 11.1928 11.8779 14.983 9.19385 9.1566 9.71999 5.85692 7.32223 numMergedOcc 0
16 mol 253 unq 1 iso 0 dist 5.86892 8.71119 11.1928 11.8779 14.983 9.19385 14.0212 16.0169 6.0222 8.31064 numMergedOcc 0
17 mol 253 unq 2 iso 0 dist 5.86892 8.71119 11.1928 15.4152 19.3531 9.1927 14.0212 16.0169 6.0222 6.73034 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 5.30455 6.69951 9.58753 8.70769 9.12507 8.25897 6.42725 5.59901 5.97386 5.30224 numMergedOcc 0
19 mol 259 unq 1 iso 0 dist 6.8184 6.69951 6.78897 8.70769 9.57887 8.25897 6.42725 4.30432 5.97386 5.30224 numMergedOcc 0
