0 mol 65 unq 0 iso 0 dist 9.9997 8.24043 6.72639 14.9355 6.80796 8.9161 numMergedOcc 0
1 mol 65 unq 1 iso 0 dist 9.9997 11.819 9.34791 14.9355 6.80796 7.31505 numMergedOcc 0
2 mol 65 unq 2 iso 0 dist 9.38611 4.91428 6.76508 12.249 5.06408 8.9161 numMergedOcc 0
3 mol 65 unq 3 iso 0 dist 9.38611 7.66509 8.22785 12.249 5.06408 7.31505 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 7.47827 3.98211 9.30539 8.56547 7.45926 7.42828 numMergedOcc 0
5 mol 91 unq 1 iso 0 dist 7.47827 3.98211 9.30539 5.23177 5.55005 5.98441 numMergedOcc 0
6 mol 91 unq 2 iso 0 dist 7.47827 3.98211 9.30539 6.77052 9.57561 5.45873 numMergedOcc 0
7 mol 91 unq 3 iso 0 dist 7.47827 6.76611 9.01176 5.23177 5.55005 5.61819 numMergedOcc 0
8 mol 91 unq 4 iso 0 dist 7.47827 6.76611 9.01176 6.77052 9.57561 6.97995 numMergedOcc 0
9 mol 91 unq 5 iso 0 dist 7.28711 9.98867 5.73743 9.23907 5.27581 4.86532 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 8.91837 10.5258 7.02927 11.6527 6.24368 6.45174 numMergedOcc 0
11 mol 109 unq 1 iso 0 dist 8.91837 10.5258 7.02927 13.4366 7.32041 8.70427 numMergedOcc 0
12 mol 109 unq 2 iso 0 dist 8.91837 5.61989 6.60933 11.6527 6.24368 8.46446 numMergedOcc 0
13 mol 109 unq 3 iso 0 dist 8.91837 5.61989 6.60933 14.9119 10.6579 9.32181 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 8.76613 5.45718 7.70232 13.1336 7.31538 9.40308 numMergedOcc 0
15 mol 117 unq 1 iso 0 dist 8.76613 6.25846 7.4671 13.1336 7.31538 8.00497 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 9.75558 9.62363 9.97343 15.7922 16.1376 6.8891 numMergedOcc 0
17 mol 167 unq 0 iso 0 dist 6.64164 10.2539 9.67741 12.0156 9.58044 9.83216 numMergedOcc 0
18 mol 182 unq 0 iso 0 dist 6.31492 11.1247 7.09394 16.2519 11.8631 9.38111 numMergedOcc 0
19 mol 182 unq 1 iso 0 dist 7.8621 5.77163 7.09394 6.06892 11.8631 9.38111 numMergedOcc 0
20 mol 218 unq 0 iso 0 dist 5.52981 5.3192 6.1951 6.43416 6.75711 8.88206 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 7.2527 10.0472 7.57812 7.24101 10.2134 6.62283 numMergedOcc 0
22 mol 238 unq 1 iso 0 dist 7.2527 10.0651 8.69104 7.24101 10.2134 8.60978 numMergedOcc 0
23 mol 238 unq 2 iso 0 dist 7.13194 10.0472 9.24557 7.24101 5.88384 6.62283 numMergedOcc 0
24 mol 238 unq 3 iso 0 dist 9.29203 13.6806 7.57812 12.3559 10.2134 6.62283 numMergedOcc 0
25 mol 238 unq 4 iso 0 dist 9.29203 16.2617 8.69104 12.3559 10.2134 8.60978 numMergedOcc 0
26 mol 238 unq 5 iso 0 dist 7.80166 13.6806 9.24557 12.3559 5.88384 6.62283 numMergedOcc 0
27 mol 249 unq 0 iso 0 dist 6.42827 5.74889 5.48118 7.10933 8.71871 6.7282 numMergedOcc 0
