0 mol 2 unq 0 iso 0 dist 5.42021 8.5893 11.5155 6.93149 9.78005 14.9062 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 5.42021 8.5893 11.5155 4.00237 6.89072 5.74846 numMergedOcc 0
2 mol 2 unq 2 iso 0 dist 5.42021 8.29974 8.29487 6.93149 9.78005 15.0413 numMergedOcc 0
3 mol 2 unq 3 iso 0 dist 5.42021 8.29974 8.29487 4.00237 6.89072 4.93584 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 5.81747 8.11934 6.8954 4.82623 4.90216 6.10199 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 5.81747 8.11934 6.8954 8.76577 9.84217 15.652 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 9.84346 9.739 12.0321 15.9532 8.48827 12.6919 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 9.84346 9.739 12.0321 14.6188 7.14048 11.2592 numMergedOcc 0
8 mol 78 unq 2 iso 0 dist 9.46472 9.739 8.84528 15.9532 8.03895 12.6919 numMergedOcc 0
9 mol 78 unq 3 iso 0 dist 9.46472 9.739 8.84528 14.6188 5.68873 11.2592 numMergedOcc 0
10 mol 81 unq 0 iso 0 dist 5.96486 8.18695 8.74391 5.82911 9.53663 5.2168 numMergedOcc 0
11 mol 127 unq 0 iso 0 dist 9.16999 9.91321 9.21978 4.96315 8.94636 9.63231 numMergedOcc 0
12 mol 163 unq 0 iso 0 dist 7.5447 6.54995 7.55428 15.4278 9.37245 16.9215 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 8.44483 7.43598 10.2769 4.24401 7.78577 11.1294 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 8.59783 9.2747 14.1071 14.5273 7.06555 19.0666 numMergedOcc 0
15 mol 171 unq 1 iso 0 dist 8.59783 8.45343 12.3288 14.5273 7.06555 15.5257 numMergedOcc 0
16 mol 176 unq 0 iso 0 dist 7.4839 8.49845 6.08965 7.59772 8.13136 12.9738 numMergedOcc 0
17 mol 176 unq 1 iso 0 dist 9.70481 9.7804 8.79663 6.25591 8.13136 12.999 numMergedOcc 0
18 mol 176 unq 2 iso 0 dist 6.59532 9.65262 11.9861 3.47653 8.13136 12.8773 numMergedOcc 0
19 mol 183 unq 0 iso 0 dist 8.7143 8.76105 7.7128 11.4328 8.00119 15.1007 numMergedOcc 0
20 mol 183 unq 1 iso 0 dist 8.7143 8.76105 7.7128 11.1045 5.50896 12.9408 numMergedOcc 0
21 mol 185 unq 0 iso 0 dist 9.56016 6.83972 4.27185 5.80135 8.07469 8.22259 numMergedOcc 0
22 mol 185 unq 1 iso 0 dist 9.56016 6.70069 12.2909 5.80135 8.07469 12.1344 numMergedOcc 0
23 mol 232 unq 0 iso 0 dist 5.29561 6.15462 3.49606 5.28999 9.4726 10.2748 numMergedOcc 0
24 mol 232 unq 1 iso 0 dist 9.16638 6.15462 7.81388 5.28999 9.33969 10.2748 numMergedOcc 0
25 mol 232 unq 2 iso 0 dist 9.16638 6.15462 7.81388 10.1458 7.64079 11.8696 numMergedOcc 0
26 mol 254 unq 0 iso 0 dist 9.03136 8.69525 9.29112 3.67192 9.93669 11.8983 numMergedOcc 0
27 mol 283 unq 0 iso 0 dist 8.36393 7.81415 3.27256 15.5185 9.35302 9.74797 numMergedOcc 0
28 mol 283 unq 1 iso 0 dist 8.36393 7.81415 3.27256 6.35533 8.85163 9.90494 numMergedOcc 0
29 mol 286 unq 0 iso 0 dist 5.03123 8.95266 6.41589 9.30848 8.87916 6.87255 numMergedOcc 0
30 mol 286 unq 1 iso 0 dist 5.03123 8.95266 6.41589 3.90927 8.27359 10.6455 numMergedOcc 0
31 mol 286 unq 2 iso 0 dist 5.03123 8.95266 6.41589 3.85003 8.14957 12.7863 numMergedOcc 0
