0 mol 59 unq 0 iso 0 dist 4.67917 6.65344 5.34079 5.96516 9.34271 12.3053 5.29688 8.05508 6.85766 10.1462 numMergedOcc 0
1 mol 59 unq 1 iso 0 dist 4.67917 6.65344 5.34079 5.96516 9.34271 12.3053 13.1729 12.5028 7.71095 18.9572 numMergedOcc 0
2 mol 59 unq 2 iso 0 dist 5.81747 8.05508 12.0007 4.82623 4.90216 12.3441 5.34079 10.9882 6.85766 9.60641 numMergedOcc 0
3 mol 59 unq 3 iso 0 dist 5.81747 8.05508 12.0007 8.76577 9.84217 14.3191 5.34079 10.9882 6.85766 9.68941 numMergedOcc 0
4 mol 59 unq 4 iso 0 dist 5.81747 9.00229 10.9658 4.82623 4.90216 8.30217 10.1484 14.2274 8.95999 9.65136 numMergedOcc 0
5 mol 59 unq 5 iso 0 dist 5.81747 9.00229 10.9658 8.76577 9.84217 17.5124 10.1484 14.2274 8.95999 15.7191 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 9.64281 8.89481 14.0364 5.96967 7.08403 7.02367 4.36935 10.783 5.86073 5.37655 numMergedOcc 0
7 mol 120 unq 0 iso 0 dist 8.43293 7.04864 5.89379 6.03314 9.58434 10.2878 4.5543 12.2464 8.75408 9.00883 numMergedOcc 0
8 mol 120 unq 1 iso 0 dist 8.43293 7.04864 5.89379 6.03314 9.58434 10.2878 6.81949 11.2107 6.44653 9.4846 numMergedOcc 0
9 mol 120 unq 2 iso 0 dist 8.43293 7.04864 5.89379 4.74539 9.16089 6.42623 4.5543 12.2464 8.75408 5.6295 numMergedOcc 0
10 mol 120 unq 3 iso 0 dist 8.43293 7.04864 5.89379 4.74539 9.16089 6.42623 6.81949 11.2107 6.44653 3.824 numMergedOcc 0
11 mol 127 unq 0 iso 0 dist 9.16999 9.42513 4.70935 4.96315 8.94636 11.0803 8.60326 9.8685 9.30299 12.1887 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 9.0455 9.28278 5.56946 3.54691 7.84813 7.97548 14.5776 13.5311 8.54584 12.5321 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 7.12336 5.86531 5.37072 5.56456 8.52036 10.3827 6.26797 9.50322 7.11802 10.3893 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 7.12336 5.86531 5.37072 5.56456 8.52036 10.3827 9.73435 5.82404 8.00618 11.323 numMergedOcc 0
15 mol 196 unq 0 iso 0 dist 7.556 9.99314 4.59462 12.9475 8.3151 10.1238 6.70722 6.87731 9.62191 7.02978 numMergedOcc 0
16 mol 196 unq 1 iso 0 dist 7.556 6.87731 6.70722 7.96489 6.10505 11.2788 4.59462 9.99314 9.62191 10.3492 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 8.80167 4.84709 5.67031 6.62122 9.68612 9.06459 4.55245 10.961 8.82096 4.15355 numMergedOcc 0
18 mol 235 unq 0 iso 0 dist 8.92054 9.11256 5.23741 3.76405 8.1174 8.08965 6.84447 8.48065 5.4638 4.75609 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 5.30455 9.12507 8.70769 9.58753 6.69951 8.25897 5.59901 6.42725 5.30224 5.97386 numMergedOcc 0
