0 mol 2 unq 0 iso 0 dist 5.42021 9.15006 4.09189 6.93149 9.78005 12.2141 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 5.42021 9.15006 4.09189 4.00237 6.89072 10.1005 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 9.47718 9.14996 14.9502 6.54685 8.79378 15.2275 numMergedOcc 0
3 mol 46 unq 1 iso 0 dist 9.47718 8.9459 10.9654 6.54685 8.79378 9.7691 numMergedOcc 0
4 mol 46 unq 2 iso 0 dist 8.9459 9.14996 16.2907 6.54685 9.7691 15.2275 numMergedOcc 0
5 mol 46 unq 3 iso 0 dist 8.9459 9.47718 10.9654 6.54685 9.7691 8.79378 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 4.67917 6.88924 3.8971 5.96516 9.34271 10.3635 numMergedOcc 0
7 mol 59 unq 1 iso 0 dist 5.81747 6.81975 3.8971 7.53537 9.34271 10.3635 numMergedOcc 0
8 mol 59 unq 2 iso 0 dist 5.81747 4.67917 7.14954 4.82623 4.90216 8.7777 numMergedOcc 0
9 mol 59 unq 3 iso 0 dist 5.81747 4.67917 7.14954 8.76577 9.84217 10.3251 numMergedOcc 0
10 mol 59 unq 4 iso 0 dist 6.81975 6.88924 7.14954 6.24283 4.90216 8.7777 numMergedOcc 0
11 mol 59 unq 5 iso 0 dist 6.81975 6.88924 7.14954 5.00893 9.84217 10.3251 numMergedOcc 0
12 mol 78 unq 0 iso 0 dist 9.84346 9.46472 3.93133 15.9532 8.48827 8.03895 numMergedOcc 0
13 mol 78 unq 1 iso 0 dist 9.84346 9.46472 3.93133 14.6188 7.14048 5.68873 numMergedOcc 0
14 mol 78 unq 2 iso 0 dist 9.46472 9.84346 3.93133 15.9532 8.03895 8.48827 numMergedOcc 0
15 mol 78 unq 3 iso 0 dist 9.46472 9.84346 3.93133 14.6188 5.68873 7.14048 numMergedOcc 0
16 mol 92 unq 0 iso 0 dist 9.59503 9.61119 7.25233 8.46944 5.04673 11.1082 numMergedOcc 0
17 mol 92 unq 1 iso 0 dist 9.59503 9.16403 14.0753 13.947 7.29864 19.9523 numMergedOcc 0
18 mol 92 unq 2 iso 0 dist 9.59503 9.16403 14.0753 14.5986 7.7399 14.3809 numMergedOcc 0
19 mol 169 unq 0 iso 0 dist 9.83308 8.97159 12.4235 3.89732 9.58901 12.436 numMergedOcc 0
20 mol 169 unq 1 iso 0 dist 8.44483 9.79864 8.84626 4.24401 7.78577 12.4926 numMergedOcc 0
21 mol 169 unq 2 iso 0 dist 8.44483 9.73241 16.2413 4.24401 7.78577 13.7977 numMergedOcc 0
22 mol 176 unq 0 iso 0 dist 7.4839 8.13465 10.2653 7.59772 8.13136 14.1061 numMergedOcc 0
23 mol 176 unq 1 iso 0 dist 7.4839 9.09742 7.44775 7.59772 8.13136 13.6121 numMergedOcc 0
24 mol 183 unq 0 iso 0 dist 8.15747 8.74903 3.75614 13.3248 7.16035 9.61725 numMergedOcc 0
25 mol 183 unq 1 iso 0 dist 8.15747 8.74903 3.75614 9.03854 6.2675 9.52042 numMergedOcc 0
26 mol 183 unq 2 iso 0 dist 8.74903 8.15747 3.75614 13.3248 9.61725 7.16035 numMergedOcc 0
27 mol 183 unq 3 iso 0 dist 8.74903 8.15747 3.75614 9.03854 9.52042 6.2675 numMergedOcc 0
28 mol 183 unq 4 iso 0 dist 5.44125 8.15747 12.9125 5.27311 8.00119 11.3231 numMergedOcc 0
29 mol 183 unq 5 iso 0 dist 5.44125 8.15747 12.9125 6.58331 5.50896 13.9507 numMergedOcc 0
30 mol 183 unq 6 iso 0 dist 5.44125 7.11505 3.75614 3.4049 7.16035 9.61725 numMergedOcc 0
31 mol 183 unq 7 iso 0 dist 5.44125 7.11505 3.75614 7.30851 6.2675 9.52042 numMergedOcc 0
32 mol 183 unq 8 iso 0 dist 5.44125 8.7143 9.96454 3.4049 7.16035 9.01531 numMergedOcc 0
33 mol 183 unq 9 iso 0 dist 5.44125 8.7143 9.96454 7.30851 6.2675 10.5413 numMergedOcc 0
34 mol 183 unq 10 iso 0 dist 7.11505 8.74903 12.9125 3.84394 8.00119 11.3231 numMergedOcc 0
35 mol 183 unq 11 iso 0 dist 7.11505 8.74903 12.9125 5.46887 5.50896 13.9507 numMergedOcc 0
36 mol 183 unq 12 iso 0 dist 7.11505 5.44125 3.75614 3.4049 9.61725 7.16035 numMergedOcc 0
37 mol 183 unq 13 iso 0 dist 7.11505 5.44125 3.75614 7.30851 9.52042 6.2675 numMergedOcc 0
38 mol 183 unq 14 iso 0 dist 7.11505 8.7143 12.8714 3.4049 9.61725 9.01531 numMergedOcc 0
39 mol 183 unq 15 iso 0 dist 7.11505 8.7143 12.8714 7.30851 9.52042 10.5413 numMergedOcc 0
40 mol 183 unq 16 iso 0 dist 8.7143 5.44125 9.96454 3.4049 9.01531 7.16035 numMergedOcc 0
41 mol 183 unq 17 iso 0 dist 8.7143 7.11505 12.8714 3.4049 9.01531 9.61725 numMergedOcc 0
42 mol 185 unq 0 iso 0 dist 9.56016 7.92501 11.1645 5.80135 8.07469 12.7168 numMergedOcc 0
43 mol 185 unq 1 iso 0 dist 9.56016 9.52252 9.83918 8.58853 9.1549 14.8121 numMergedOcc 0
44 mol 185 unq 2 iso 0 dist 7.92501 8.27418 6.40496 6.49781 9.1549 11.984 numMergedOcc 0
45 mol 232 unq 0 iso 0 dist 5.29561 9.16638 9.9868 5.28999 9.4726 9.33969 numMergedOcc 0
46 mol 232 unq 1 iso 0 dist 9.16638 5.29561 9.9868 5.28999 9.33969 9.4726 numMergedOcc 0
47 mol 232 unq 2 iso 0 dist 9.16638 5.29561 9.9868 10.1458 7.64079 13.793 numMergedOcc 0
48 mol 259 unq 0 iso 0 dist 5.30455 7.34794 4.24996 9.58753 6.69951 10.3558 numMergedOcc 0
