0 mol 0 unq 0 iso 0 dist 8.24206 5.25456 7.37981 13.7029 10.169 9.23213 10.4777 11.9257 8.81979 9.14029 numMergedOcc 0
1 mol 0 unq 0 iso 1 dist 8.24206 5.25456 7.37981 10.4777 11.9257 8.81979 13.7029 10.169 9.23213 9.14029 numMergedOcc 0
2 mol 0 unq 1 iso 0 dist 6.19218 5.25456 7.19621 13.7029 11.8799 9.23213 10.4777 5.13546 8.81979 9.14029 numMergedOcc 0
3 mol 0 unq 1 iso 1 dist 6.19218 5.25456 7.19621 10.4777 5.13546 8.81979 13.7029 11.8799 9.23213 9.14029 numMergedOcc 0
4 mol 0 unq 2 iso 0 dist 7.19397 7.1599 7.19621 14.4883 11.8799 9.23213 9.45712 5.13546 8.81979 9.14029 numMergedOcc 0
5 mol 0 unq 2 iso 1 dist 7.19397 7.1599 7.19621 9.45712 5.13546 8.81979 14.4883 11.8799 9.23213 9.14029 numMergedOcc 0
6 mol 7 unq 0 iso 0 dist 9.90117 6.96396 7.21217 13.6699 9.17096 7.31201 13.3157 12.4418 9.36807 6.57017 numMergedOcc 0
7 mol 7 unq 0 iso 1 dist 9.90117 6.96396 7.21217 13.3157 12.4418 9.36807 13.6699 9.17096 7.31201 6.57017 numMergedOcc 0
8 mol 16 unq 0 iso 0 dist 7.88676 6.06561 8.67719 9.47421 5.1298 6.58035 12.3246 13.18 8.41862 10.9633 numMergedOcc 0
9 mol 16 unq 0 iso 1 dist 7.88676 6.06561 8.67719 12.3246 13.18 8.41862 9.47421 5.1298 6.58035 10.9633 numMergedOcc 0
10 mol 64 unq 0 iso 0 dist 7.8986 9.48441 6.6003 13.1196 5.29079 9.80142 11.4891 5.78769 9.54144 6.23335 numMergedOcc 0
11 mol 64 unq 0 iso 1 dist 7.8986 9.48441 6.6003 11.4891 5.78769 9.54144 13.1196 5.29079 9.80142 6.23335 numMergedOcc 0
12 mol 64 unq 1 iso 0 dist 7.24183 6.41829 6.6003 11.9614 5.29079 9.80142 8.64746 5.78769 9.54144 6.23335 numMergedOcc 0
13 mol 64 unq 1 iso 1 dist 7.24183 6.41829 6.6003 8.64746 5.78769 9.54144 11.9614 5.29079 9.80142 6.23335 numMergedOcc 0
14 mol 194 unq 0 iso 0 dist 5.69763 11.4562 9.48439 10.68 8.68698 5.48258 14.4326 10.0346 6.15769 7.46053 numMergedOcc 0
15 mol 194 unq 0 iso 1 dist 5.69763 11.4562 9.48439 14.4326 10.0346 6.15769 10.68 8.68698 5.48258 7.46053 numMergedOcc 0
16 mol 194 unq 1 iso 0 dist 7.38622 5.55582 7.32478 10.0242 7.54928 5.48258 8.40972 5.45144 6.15769 7.46053 numMergedOcc 0
17 mol 194 unq 1 iso 1 dist 7.38622 5.55582 7.32478 8.40972 5.45144 6.15769 10.0242 7.54928 5.48258 7.46053 numMergedOcc 0
18 mol 194 unq 2 iso 0 dist 8.82165 5.55582 9.48439 10.0242 8.68698 5.48258 8.40972 10.0346 6.15769 7.46053 numMergedOcc 0
19 mol 194 unq 2 iso 1 dist 8.82165 5.55582 9.48439 8.40972 10.0346 6.15769 10.0242 8.68698 5.48258 7.46053 numMergedOcc 0
20 mol 197 unq 0 iso 0 dist 8.51118 8.58314 8.64255 14.8934 10.1284 8.99696 10.7501 9.91133 7.85058 14.5931 numMergedOcc 0
21 mol 197 unq 0 iso 1 dist 8.51118 8.58314 8.64255 10.7501 9.91133 7.85058 14.8934 10.1284 8.99696 14.5931 numMergedOcc 0
22 mol 197 unq 1 iso 0 dist 8.51118 8.58314 8.64255 14.8934 10.1284 8.99696 15.3308 8.50763 9.96638 8.44549 numMergedOcc 0
23 mol 197 unq 1 iso 1 dist 8.51118 8.58314 8.64255 15.3308 8.50763 9.96638 14.8934 10.1284 8.99696 8.44549 numMergedOcc 0
24 mol 197 unq 1 iso 0 dist 8.51118 8.58314 8.64255 10.7501 9.91133 7.85058 15.3308 8.50763 9.96638 10.0338 numMergedOcc 0
25 mol 197 unq 1 iso 1 dist 8.51118 8.58314 8.64255 15.3308 8.50763 9.96638 10.7501 9.91133 7.85058 10.0338 numMergedOcc 0
26 mol 214 unq 0 iso 0 dist 9.81136 17.404 8.49704 20.6393 13.4309 6.97182 20.8927 13.5787 6.1175 5.93129 numMergedOcc 0
27 mol 214 unq 0 iso 1 dist 9.81136 17.404 8.49704 20.8927 13.5787 6.1175 20.6393 13.4309 6.97182 5.93129 numMergedOcc 0
28 mol 220 unq 0 iso 0 dist 7.57712 6.19375 7.31105 12.6808 12.3402 6.84247 5.00266 7.84277 6.99002 11.5311 numMergedOcc 0
29 mol 220 unq 0 iso 1 dist 7.57712 6.19375 7.31105 5.00266 7.84277 6.99002 12.6808 12.3402 6.84247 11.5311 numMergedOcc 0
30 mol 224 unq 0 iso 0 dist 7.58998 6.87755 6.23882 8.76325 9.57742 7.06793 12.0468 12.0368 6.67585 6.88258 numMergedOcc 0
31 mol 224 unq 0 iso 1 dist 7.58998 6.87755 6.23882 12.0468 12.0368 6.67585 8.76325 9.57742 7.06793 6.88258 numMergedOcc 0
32 mol 227 unq 0 iso 0 dist 5.2851 5.14019 9.18675 6.20188 6.07589 5.86443 9.47836 9.95811 7.22914 5.76653 numMergedOcc 0
33 mol 227 unq 0 iso 1 dist 5.2851 5.14019 9.18675 9.47836 9.95811 7.22914 6.20188 6.07589 5.86443 5.76653 numMergedOcc 0
34 mol 238 unq 0 iso 0 dist 5.57184 7.01206 5.24313 11.1838 6.03021 6.55759 9.40892 5.27451 7.02475 6.44245 numMergedOcc 0
35 mol 238 unq 0 iso 1 dist 5.57184 7.01206 5.24313 9.40892 5.27451 7.02475 11.1838 6.03021 6.55759 6.44245 numMergedOcc 0
36 mol 238 unq 1 iso 0 dist 5.57184 7.01206 5.24313 11.1838 6.03021 6.55759 6.40309 6.23871 7.67322 10.677 numMergedOcc 0
37 mol 238 unq 1 iso 1 dist 5.57184 7.01206 5.24313 6.40309 6.23871 7.67322 11.1838 6.03021 6.55759 10.677 numMergedOcc 0
38 mol 238 unq 2 iso 0 dist 5.57184 7.01206 5.24313 11.1838 6.03021 6.55759 11.5826 11.3884 7.19008 12.1411 numMergedOcc 0
39 mol 238 unq 2 iso 1 dist 5.57184 7.01206 5.24313 11.5826 11.3884 7.19008 11.1838 6.03021 6.55759 12.1411 numMergedOcc 0
40 mol 238 unq 1 iso 0 dist 5.57184 7.01206 5.24313 9.40892 5.27451 7.02475 6.40309 6.23871 7.67322 5.44694 numMergedOcc 0
41 mol 238 unq 1 iso 1 dist 5.57184 7.01206 5.24313 6.40309 6.23871 7.67322 9.40892 5.27451 7.02475 5.44694 numMergedOcc 0
42 mol 238 unq 2 iso 0 dist 5.57184 7.01206 5.24313 9.40892 5.27451 7.02475 11.5826 11.3884 7.19008 10.1756 numMergedOcc 0
43 mol 238 unq 2 iso 1 dist 5.57184 7.01206 5.24313 11.5826 11.3884 7.19008 9.40892 5.27451 7.02475 10.1756 numMergedOcc 0
44 mol 238 unq 2 iso 0 dist 5.57184 7.01206 5.24313 6.40309 6.23871 7.67322 11.5826 11.3884 7.19008 9.50847 numMergedOcc 0
45 mol 238 unq 2 iso 1 dist 5.57184 7.01206 5.24313 11.5826 11.3884 7.19008 6.40309 6.23871 7.67322 9.50847 numMergedOcc 0
