0 mol 0 unq 0 iso 0 dist 8.24206 5.25456 7.37981 13.7029 10.169 9.23213 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 8.24206 5.25456 7.37981 10.4777 11.9257 8.81979 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 6.19218 5.25456 7.19621 13.7029 11.8799 9.23213 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 6.19218 5.25456 7.19621 10.4777 5.13546 8.81979 numMergedOcc 0
4 mol 0 unq 4 iso 0 dist 7.19397 7.1599 7.19621 14.4883 11.8799 9.23213 numMergedOcc 0
5 mol 0 unq 5 iso 0 dist 7.19397 7.1599 7.19621 9.45712 5.13546 8.81979 numMergedOcc 0
6 mol 7 unq 0 iso 0 dist 9.90117 6.96396 7.21217 13.6699 9.17096 7.31201 numMergedOcc 0
7 mol 7 unq 1 iso 0 dist 9.90117 6.96396 7.21217 13.3157 12.4418 9.36807 numMergedOcc 0
8 mol 11 unq 0 iso 0 dist 9.36555 9.67404 6.79478 16.3796 16.1353 9.53002 numMergedOcc 0
9 mol 16 unq 0 iso 0 dist 7.88676 5.66097 5.84479 9.47421 5.1298 5.47769 numMergedOcc 0
10 mol 16 unq 1 iso 0 dist 7.88676 6.06561 8.67719 9.47421 5.1298 6.58035 numMergedOcc 0
11 mol 16 unq 2 iso 0 dist 7.88676 6.06561 8.67719 12.3246 13.18 8.41862 numMergedOcc 0
12 mol 19 unq 0 iso 0 dist 9.50382 11.8354 9.69454 14.662 8.47464 6.00439 numMergedOcc 0
13 mol 19 unq 1 iso 0 dist 8.76559 5.67097 9.69454 10.1117 8.47464 6.00439 numMergedOcc 0
14 mol 54 unq 0 iso 0 dist 6.79881 5.92411 5.94778 5.53875 4.94373 6.91734 numMergedOcc 0
15 mol 54 unq 1 iso 0 dist 9.89535 5.77755 5.94778 10.5566 4.94373 6.91734 numMergedOcc 0
16 mol 61 unq 0 iso 0 dist 8.30431 6.32949 9.62468 10.6661 6.91052 8.76003 numMergedOcc 0
17 mol 61 unq 1 iso 0 dist 4.628 6.32949 5.92705 10.6661 7.34319 8.76003 numMergedOcc 0
18 mol 64 unq 0 iso 0 dist 7.8986 9.48441 6.6003 13.1196 5.29079 9.80142 numMergedOcc 0
19 mol 64 unq 1 iso 0 dist 7.8986 9.48441 6.6003 11.4891 5.78769 9.54144 numMergedOcc 0
20 mol 64 unq 2 iso 0 dist 7.24183 6.41829 6.6003 11.9614 5.29079 9.80142 numMergedOcc 0
21 mol 64 unq 3 iso 0 dist 7.24183 6.41829 6.6003 8.64746 5.78769 9.54144 numMergedOcc 0
22 mol 100 unq 0 iso 0 dist 5.61016 9.7552 7.88564 9.35867 5.07584 4.76815 numMergedOcc 0
23 mol 100 unq 1 iso 0 dist 7.11187 6.67262 6.78459 10.4737 7.59628 4.76815 numMergedOcc 0
24 mol 100 unq 2 iso 0 dist 6.60356 9.96864 6.78459 12.0659 7.59628 4.76815 numMergedOcc 0
25 mol 102 unq 0 iso 0 dist 5.43401 7.49575 9.10229 6.793 6.83631 9.94856 numMergedOcc 0
26 mol 114 unq 0 iso 0 dist 5.31281 5.24877 8.42445 11.3006 10.453 8.71128 numMergedOcc 0
27 mol 175 unq 0 iso 0 dist 6.21546 5.73338 8.69888 15.0771 14.6255 9.8589 numMergedOcc 0
28 mol 175 unq 1 iso 0 dist 6.03184 5.73338 5.08206 15.0771 11.5085 9.8589 numMergedOcc 0
29 mol 178 unq 0 iso 0 dist 8.14441 13.6129 8.0974 19.3356 11.6559 8.96511 numMergedOcc 0
30 mol 194 unq 0 iso 0 dist 5.69763 11.4562 9.48439 10.68 8.68698 5.48258 numMergedOcc 0
31 mol 194 unq 1 iso 0 dist 5.69763 11.4562 9.48439 14.4326 10.0346 6.15769 numMergedOcc 0
32 mol 194 unq 2 iso 0 dist 7.38622 5.55582 7.32478 10.0242 7.54928 5.48258 numMergedOcc 0
33 mol 194 unq 3 iso 0 dist 7.38622 5.55582 7.32478 8.40972 5.45144 6.15769 numMergedOcc 0
34 mol 194 unq 4 iso 0 dist 8.82165 5.55582 9.48439 10.0242 8.68698 5.48258 numMergedOcc 0
35 mol 194 unq 5 iso 0 dist 8.82165 5.55582 9.48439 8.40972 10.0346 6.15769 numMergedOcc 0
36 mol 197 unq 0 iso 0 dist 8.51118 8.58314 8.64255 14.8934 10.1284 8.99696 numMergedOcc 0
37 mol 197 unq 1 iso 0 dist 8.51118 8.58314 8.64255 10.7501 9.91133 7.85058 numMergedOcc 0
38 mol 197 unq 2 iso 0 dist 8.51118 8.58314 8.64255 15.3308 8.50763 9.96638 numMergedOcc 0
39 mol 214 unq 0 iso 0 dist 9.81136 17.404 8.49704 20.6393 13.4309 6.97182 numMergedOcc 0
40 mol 214 unq 1 iso 0 dist 9.81136 17.404 8.49704 20.8927 13.5787 6.1175 numMergedOcc 0
41 mol 220 unq 0 iso 0 dist 7.57712 6.19375 7.31105 12.6808 12.3402 6.84247 numMergedOcc 0
42 mol 220 unq 1 iso 0 dist 7.57712 6.19375 7.31105 5.00266 7.84277 6.99002 numMergedOcc 0
43 mol 224 unq 0 iso 0 dist 7.62593 11.4653 9.33771 11.4157 11.498 6.87664 numMergedOcc 0
44 mol 224 unq 1 iso 0 dist 7.58998 6.87755 6.23882 8.76325 9.57742 7.06793 numMergedOcc 0
45 mol 224 unq 2 iso 0 dist 7.58998 6.87755 6.23882 12.0468 12.0368 6.67585 numMergedOcc 0
46 mol 227 unq 0 iso 0 dist 5.2851 5.14019 9.18675 6.20188 6.07589 5.86443 numMergedOcc 0
47 mol 227 unq 1 iso 0 dist 5.2851 5.14019 9.18675 9.47836 9.95811 7.22914 numMergedOcc 0
48 mol 235 unq 0 iso 0 dist 7.99218 10.3775 7.2346 14.4922 9.5053 7.32211 numMergedOcc 0
49 mol 238 unq 0 iso 0 dist 5.57184 9.76195 6.83152 11.1838 6.03021 5.38637 numMergedOcc 0
50 mol 238 unq 1 iso 0 dist 5.57184 7.01206 5.24313 11.1838 6.03021 6.55759 numMergedOcc 0
51 mol 238 unq 2 iso 0 dist 5.57184 7.01206 5.24313 9.40892 5.27451 7.02475 numMergedOcc 0
52 mol 238 unq 3 iso 0 dist 5.57184 7.01206 5.24313 6.40309 6.23871 7.67322 numMergedOcc 0
53 mol 238 unq 4 iso 0 dist 5.57184 7.01206 5.24313 11.5826 11.3884 7.19008 numMergedOcc 0
54 mol 238 unq 5 iso 0 dist 6.74214 6.3873 9.31417 14.7533 18.4149 9.29858 numMergedOcc 0
55 mol 238 unq 6 iso 0 dist 5.33462 6.3873 5.56719 14.7533 14.7671 9.29858 numMergedOcc 0
56 mol 248 unq 0 iso 0 dist 8.11968 9.48478 8.71859 9.83514 4.11367 6.07192 numMergedOcc 0
57 mol 249 unq 0 iso 0 dist 6.18866 6.28944 5.78121 9.02486 4.16447 8.96876 numMergedOcc 0
58 mol 249 unq 1 iso 0 dist 6.18866 12.5843 7.29898 9.02486 4.16447 8.83735 numMergedOcc 0
59 mol 249 unq 2 iso 0 dist 9.3807 12.5843 8.91685 9.02486 6.74838 8.83735 numMergedOcc 0
60 mol 258 unq 0 iso 0 dist 8.97411 4.6881 5.73296 6.73928 5.28906 6.49982 numMergedOcc 0
61 mol 259 unq 0 iso 0 dist 8.73077 16.6797 9.58006 19.8207 15.1483 7.48005 numMergedOcc 0
62 mol 259 unq 1 iso 0 dist 6.76656 12.7595 9.58006 15.1733 15.1483 7.48005 numMergedOcc 0
63 mol 277 unq 0 iso 0 dist 6.23539 7.44724 6.90434 12.4404 9.14131 9.41725 numMergedOcc 0
64 mol 278 unq 0 iso 0 dist 8.87405 8.66976 9.82774 9.95186 4.8589 6.35287 numMergedOcc 0
65 mol 282 unq 0 iso 0 dist 7.93511 9.67023 5.67266 13.2331 5.41716 8.8673 numMergedOcc 0
66 mol 282 unq 1 iso 0 dist 5.62497 8.13794 9.63346 15.6696 14.5422 8.8673 numMergedOcc 0
67 mol 284 unq 0 iso 0 dist 8.60951 4.59796 8.10742 8.7448 4.93259 7.52785 numMergedOcc 0
