0 mol 13 unq 0 iso 0 dist 8.26888 5.21049 9.1093 7.0496 7.71544 10.2967 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 8.25257 7.8714 5.61893 4.56987 9.43863 7.18692 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.07029 12.921 8.07937 7.54726 8.6112 16.0447 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 9.07029 7.62792 6.42206 7.54726 8.6112 4.20567 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 9.07029 15.6943 9.66602 7.54726 8.6112 9.87081 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 9.00045 4.93105 6.27186 8.98763 9.46472 11.1106 numMergedOcc 0
6 mol 81 unq 0 iso 0 dist 9.12919 7.67847 8.68497 11.1775 5.96486 11.4303 numMergedOcc 0
7 mol 103 unq 0 iso 0 dist 4.9418 5.07478 6.79564 12.2608 9.57953 14.4499 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 9.00111 5.07153 4.87856 7.17914 7.59374 4.91384 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 7.92498 6.31058 8.28452 12.3412 9.64281 6.68968 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 7.92498 11.6347 8.44004 12.3412 9.64281 12.1395 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 6.74947 6.24568 8.0302 8.24148 9.70977 6.39449 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 6.74947 7.74601 6.65051 8.24148 9.70977 4.67765 numMergedOcc 0
13 mol 141 unq 2 iso 0 dist 6.74947 10.8712 9.41519 8.24148 9.70977 4.37189 numMergedOcc 0
14 mol 165 unq 0 iso 0 dist 9.13914 5.29527 7.6166 7.37861 7.65047 6.17559 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 8.11268 6.33958 8.56204 12.4151 9.83308 6.80229 numMergedOcc 0
16 mol 169 unq 1 iso 0 dist 8.11268 6.33958 8.56204 12.392 8.97159 11.5857 numMergedOcc 0
17 mol 176 unq 0 iso 0 dist 9.44083 6.55581 9.60497 10.0711 6.59532 5.84577 numMergedOcc 0
18 mol 176 unq 1 iso 0 dist 7.0591 5.12864 9.60497 4.60703 6.59532 5.84577 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 7.55878 15.0896 9.49046 3.73772 7.74693 13.0673 numMergedOcc 0
20 mol 233 unq 1 iso 0 dist 7.55878 9.27865 7.24533 3.73772 7.74693 8.90679 numMergedOcc 0
21 mol 233 unq 2 iso 0 dist 4.91191 6.6982 9.49046 10.5268 7.74693 13.0673 numMergedOcc 0
22 mol 233 unq 3 iso 0 dist 4.91191 4.98124 7.24533 10.5268 7.74693 8.90679 numMergedOcc 0
23 mol 247 unq 0 iso 0 dist 6.35578 6.74468 9.79737 7.03663 9.65548 3.80357 numMergedOcc 0
24 mol 247 unq 1 iso 0 dist 6.35578 6.74468 9.79737 3.80277 8.05213 8.72908 numMergedOcc 0
25 mol 247 unq 2 iso 0 dist 6.35578 6.74468 9.79737 11.9252 8.67304 16.8289 numMergedOcc 0
26 mol 247 unq 3 iso 0 dist 6.35578 9.39272 8.34155 7.03663 9.65548 6.64203 numMergedOcc 0
27 mol 247 unq 4 iso 0 dist 6.35578 9.39272 8.34155 3.80277 8.05213 8.21392 numMergedOcc 0
28 mol 247 unq 5 iso 0 dist 6.35578 9.39272 8.34155 11.9252 8.67304 10.4393 numMergedOcc 0
29 mol 247 unq 6 iso 0 dist 6.35578 10.3476 8.30945 7.03663 9.65548 10.5234 numMergedOcc 0
30 mol 247 unq 7 iso 0 dist 6.35578 10.3476 8.30945 3.80277 8.05213 8.43499 numMergedOcc 0
31 mol 247 unq 8 iso 0 dist 6.35578 10.3476 8.30945 11.9252 8.67304 6.13686 numMergedOcc 0
32 mol 256 unq 0 iso 0 dist 9.59101 12.4486 9.36652 4.56191 7.14598 13.4771 numMergedOcc 0
33 mol 256 unq 1 iso 0 dist 9.59101 8.11848 7.54613 4.56191 7.14598 9.58759 numMergedOcc 0
34 mol 292 unq 0 iso 0 dist 8.99187 10.3947 5.76223 5.50542 8.35169 11.6897 numMergedOcc 0
