0 mol 26 unq 0 iso 0 dist 8.84763 7.19483 9.27369 5.21858 6.46104 10.2609 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.84763 7.19483 9.27369 6.29941 7.36856 8.18809 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 9.61335 12.3141 5.66743 15.1255 9.52474 9.49066 numMergedOcc 0
3 mol 27 unq 1 iso 0 dist 9.61335 15.7363 7.42669 15.1255 9.52474 4.91484 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 7.63526 5.22908 6.94677 11.9454 9.25641 8.42799 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 6.02731 13.7005 8.2746 11.4221 7.56205 4.47138 numMergedOcc 0
6 mol 62 unq 1 iso 0 dist 6.02731 13.7005 8.2746 4.05764 4.74544 10.9596 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 8.59945 16.5574 9.55838 8.48982 6.36086 9.96691 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 6.65318 4.3613 8.48774 7.12509 6.60933 11.1132 numMergedOcc 0
9 mol 109 unq 1 iso 0 dist 6.65318 9.83914 9.53055 7.12509 6.60933 6.78736 numMergedOcc 0
10 mol 113 unq 0 iso 0 dist 5.7085 12.0115 9.66068 11.4228 8.8822 16.3524 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 9.04937 4.62381 8.75431 7.79117 8.99399 10.7421 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 7.98622 9.70402 9.86988 8.48942 7.58957 7.59962 numMergedOcc 0
13 mol 146 unq 0 iso 0 dist 6.28491 3.96561 7.13378 5.15943 8.84535 8.76758 numMergedOcc 0
14 mol 146 unq 1 iso 0 dist 6.28491 3.96561 7.13378 5.67737 8.82188 6.347 numMergedOcc 0
15 mol 148 unq 0 iso 0 dist 7.91633 12.5923 9.80819 5.5847 6.22055 9.27313 numMergedOcc 0
16 mol 148 unq 1 iso 0 dist 7.91633 12.5923 9.80819 10.3708 8.18085 12.8573 numMergedOcc 0
17 mol 150 unq 0 iso 0 dist 8.11909 12.2354 9.81665 5.64485 6.14675 9.25213 numMergedOcc 0
18 mol 150 unq 1 iso 0 dist 8.11909 12.2354 9.81665 10.6142 7.94889 12.8265 numMergedOcc 0
19 mol 150 unq 2 iso 0 dist 9.21219 8.82454 9.33412 5.64485 9.24244 6.48118 numMergedOcc 0
20 mol 168 unq 0 iso 0 dist 8.80059 9.52243 8.90876 14.4671 7.44629 12.1014 numMergedOcc 0
21 mol 171 unq 0 iso 0 dist 8.53734 12.6444 6.21194 11.071 9.61462 9.22906 numMergedOcc 0
22 mol 171 unq 1 iso 0 dist 6.08141 7.0159 6.21194 10.3893 9.61462 9.22906 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 6.38654 5.64063 7.26887 6.89249 8.94014 4.39639 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 6.38654 5.64063 7.26887 9.42382 7.02333 6.57364 numMergedOcc 0
25 mol 238 unq 2 iso 0 dist 6.38654 5.64063 7.26887 11.5722 8.67864 10.9854 numMergedOcc 0
26 mol 238 unq 3 iso 0 dist 9.77185 10.1782 7.26887 9.71057 8.94014 4.39639 numMergedOcc 0
27 mol 238 unq 4 iso 0 dist 9.77185 10.1782 7.26887 4.39154 7.02333 6.57364 numMergedOcc 0
28 mol 238 unq 5 iso 0 dist 9.77185 10.1782 7.26887 6.77956 8.67864 10.9854 numMergedOcc 0
29 mol 243 unq 0 iso 0 dist 7.24253 14.1451 8.55613 6.54531 7.49645 11.7757 numMergedOcc 0
30 mol 243 unq 1 iso 0 dist 7.24253 14.1451 8.55613 11.6229 9.9222 11.9474 numMergedOcc 0
31 mol 258 unq 0 iso 0 dist 7.41653 11.4452 8.63176 6.88723 9.63959 8.27707 numMergedOcc 0
32 mol 258 unq 1 iso 0 dist 7.41653 11.4452 8.63176 7.08073 9.96262 13.5559 numMergedOcc 0
33 mol 258 unq 2 iso 0 dist 7.41653 11.4452 8.63176 11.7129 7.21311 6.48867 numMergedOcc 0
