0 mol 11 unq 0 iso 0 dist 6.29106 7.05626 7.0964 4.37231 4.30695 6.35398 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 7.05626 6.29106 7.0964 4.37231 6.35398 4.30695 numMergedOcc 0
2 mol 65 unq 0 iso 0 dist 8.9161 7.31505 5.56801 6.80796 6.72639 9.34791 numMergedOcc 0
3 mol 65 unq 1 iso 0 dist 8.9161 7.31505 5.56801 5.06408 6.76508 8.22785 numMergedOcc 0
4 mol 65 unq 2 iso 0 dist 7.31505 8.9161 5.56801 9.49186 7.90294 11.5413 numMergedOcc 0
5 mol 65 unq 3 iso 0 dist 7.31505 8.9161 5.56801 6.80796 9.34791 6.72639 numMergedOcc 0
6 mol 65 unq 4 iso 0 dist 7.31505 8.9161 5.56801 5.06408 8.22785 6.76508 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 5.98441 5.61819 9.17687 5.55005 9.30539 9.01176 numMergedOcc 0
8 mol 91 unq 1 iso 0 dist 5.45873 6.97995 9.17687 9.57561 9.30539 9.01176 numMergedOcc 0
9 mol 91 unq 2 iso 0 dist 5.61819 5.98441 9.17687 5.55005 9.01176 9.30539 numMergedOcc 0
10 mol 91 unq 3 iso 0 dist 6.97995 5.45873 9.17687 9.57561 9.01176 9.30539 numMergedOcc 0
11 mol 108 unq 0 iso 0 dist 8.00008 9.88259 9.1692 15.8859 9.01852 17.4446 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 6.45174 8.46446 10.6137 6.24368 7.02927 6.60933 numMergedOcc 0
13 mol 109 unq 1 iso 0 dist 8.46446 6.45174 10.6137 6.24368 6.60933 7.02927 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 9.40308 8.00497 4.04941 7.31538 7.70232 7.4671 numMergedOcc 0
15 mol 117 unq 1 iso 0 dist 8.00497 9.40308 4.04941 7.31538 7.4671 7.70232 numMergedOcc 0
16 mol 130 unq 0 iso 0 dist 5.65876 9.13825 6.43265 11.4341 9.72053 14.9274 numMergedOcc 0
17 mol 130 unq 1 iso 0 dist 5.65876 9.13825 6.43265 7.02907 7.7949 11.2733 numMergedOcc 0
18 mol 141 unq 0 iso 0 dist 6.8891 6.93424 6.59975 16.1376 9.97343 13.5519 numMergedOcc 0
19 mol 141 unq 1 iso 0 dist 6.8891 6.93424 6.59975 10.4675 9.70413 11.7346 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 6.62283 8.60978 6.25098 10.2134 7.57812 8.69104 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 6.62283 8.60978 6.25098 5.88384 9.24557 12.9364 numMergedOcc 0
22 mol 238 unq 2 iso 0 dist 8.60978 6.62283 6.25098 10.2134 8.69104 7.57812 numMergedOcc 0
23 mol 278 unq 0 iso 0 dist 8.91606 9.74549 15.4449 15.2651 8.00673 23.2633 numMergedOcc 0
24 mol 278 unq 1 iso 0 dist 8.91606 9.74549 15.4449 9.04802 6.62841 17.7833 numMergedOcc 0
