0 mol 2 unq 0 iso 0 dist 5.42021 9.10747 5.66327 9.39095 8.35692 10.9872 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 5.42021 9.45683 5.6648 9.39095 8.35692 5.27871 numMergedOcc 0
2 mol 2 unq 2 iso 0 dist 9.15006 9.10747 7.20793 9.39095 10.6458 10.9872 numMergedOcc 0
3 mol 2 unq 3 iso 0 dist 9.15006 9.45683 6.03752 9.39095 10.6458 5.27871 numMergedOcc 0
4 mol 10 unq 0 iso 0 dist 9.56259 5.06897 10.1818 8.44792 14.4547 4.71687 numMergedOcc 0
5 mol 10 unq 1 iso 0 dist 9.56259 5.06897 10.1818 4.94198 7.66496 3.77616 numMergedOcc 0
6 mol 10 unq 2 iso 0 dist 9.56259 5.06897 10.1818 9.62353 8.50202 12.0784 numMergedOcc 0
7 mol 26 unq 0 iso 0 dist 8.6112 9.70778 16.5552 7.89667 7.07479 12.7914 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 9.53794 6.54185 13.7738 8.48827 17.4664 9.21018 numMergedOcc 0
9 mol 78 unq 1 iso 0 dist 9.53794 6.54185 13.7738 7.14048 16.6402 7.74516 numMergedOcc 0
10 mol 78 unq 2 iso 0 dist 9.53794 9.68502 11.723 8.48827 17.4664 14.6646 numMergedOcc 0
11 mol 78 unq 3 iso 0 dist 9.53794 9.68502 11.723 7.14048 16.6402 13.7979 numMergedOcc 0
12 mol 78 unq 4 iso 0 dist 9.84346 6.54185 16.0647 8.48827 15.9532 9.21018 numMergedOcc 0
13 mol 78 unq 5 iso 0 dist 9.84346 6.54185 16.0647 7.14048 14.6188 7.74516 numMergedOcc 0
14 mol 78 unq 6 iso 0 dist 9.84346 9.68502 17.7914 8.48827 15.9532 14.6646 numMergedOcc 0
15 mol 78 unq 7 iso 0 dist 9.84346 9.68502 17.7914 7.14048 14.6188 13.7979 numMergedOcc 0
16 mol 79 unq 0 iso 0 dist 7.74131 5.69384 6.32618 7.06029 6.82396 5.47798 numMergedOcc 0
17 mol 92 unq 0 iso 0 dist 9.59503 8.95651 7.34488 7.29864 13.947 8.75014 numMergedOcc 0
18 mol 92 unq 1 iso 0 dist 9.59503 8.95651 7.34488 7.7399 14.5986 15.041 numMergedOcc 0
19 mol 92 unq 2 iso 0 dist 9.61119 8.95651 6.3035 7.29864 11.6652 8.75014 numMergedOcc 0
20 mol 92 unq 3 iso 0 dist 9.61119 8.95651 6.3035 7.7399 17.052 15.041 numMergedOcc 0
21 mol 113 unq 0 iso 0 dist 9.64281 6.20553 5.12275 7.08403 5.96967 6.39863 numMergedOcc 0
22 mol 120 unq 0 iso 0 dist 8.43293 9.27951 4.63594 9.58434 6.03314 9.74634 numMergedOcc 0
23 mol 120 unq 1 iso 0 dist 8.43293 9.27951 4.63594 9.16089 4.74539 9.23272 numMergedOcc 0
24 mol 154 unq 0 iso 0 dist 7.10223 9.2042 7.86748 6.12278 11.9194 14.9051 numMergedOcc 0
25 mol 163 unq 0 iso 0 dist 7.5447 5.80513 6.56076 9.37245 15.4278 12.99 numMergedOcc 0
26 mol 163 unq 1 iso 0 dist 9.04757 5.80513 4.9482 9.37245 13.5948 12.99 numMergedOcc 0
27 mol 169 unq 0 iso 0 dist 9.83308 6.29631 5.42467 7.33643 5.74428 6.28641 numMergedOcc 0
28 mol 169 unq 1 iso 0 dist 8.97159 6.29631 7.26938 7.33643 12.9566 6.28641 numMergedOcc 0
29 mol 171 unq 0 iso 0 dist 8.59783 7.68295 5.31547 7.06555 14.5273 12.1034 numMergedOcc 0
30 mol 196 unq 0 iso 0 dist 8.86439 7.63142 10.382 9.34759 6.16315 5.9011 numMergedOcc 0
31 mol 210 unq 0 iso 0 dist 9.718 7.31388 11.0997 9.49242 12.6983 15.3751 numMergedOcc 0
32 mol 210 unq 1 iso 0 dist 9.718 7.31388 11.0997 9.25184 12.162 7.61953 numMergedOcc 0
33 mol 210 unq 2 iso 0 dist 8.61629 7.31388 11.2533 9.49242 9.16249 15.3751 numMergedOcc 0
34 mol 210 unq 3 iso 0 dist 8.61629 7.31388 11.2533 9.25184 9.9492 7.61953 numMergedOcc 0
35 mol 232 unq 0 iso 0 dist 5.29561 9.49955 8.67887 8.00949 8.56792 12.2226 numMergedOcc 0
36 mol 232 unq 1 iso 0 dist 5.29561 9.49955 8.67887 8.19257 5.75118 5.78237 numMergedOcc 0
37 mol 232 unq 2 iso 0 dist 5.29561 7.03236 7.67378 8.00949 8.56792 14.3328 numMergedOcc 0
38 mol 232 unq 3 iso 0 dist 5.29561 7.03236 7.67378 8.19257 5.75118 4.98464 numMergedOcc 0
39 mol 232 unq 4 iso 0 dist 9.16638 9.49955 5.06557 8.00949 14.7394 12.2226 numMergedOcc 0
40 mol 232 unq 5 iso 0 dist 9.16638 9.49955 5.06557 8.19257 5.97529 5.78237 numMergedOcc 0
41 mol 232 unq 6 iso 0 dist 9.16638 7.03236 5.42475 8.00949 14.7394 14.3328 numMergedOcc 0
42 mol 232 unq 7 iso 0 dist 9.16638 7.03236 5.42475 8.19257 5.97529 4.98464 numMergedOcc 0
43 mol 285 unq 0 iso 0 dist 8.12306 6.89391 13.3596 5.28731 10.1123 6.89311 numMergedOcc 0
44 mol 286 unq 0 iso 0 dist 5.03123 7.3415 6.77784 8.87916 9.30848 9.21314 numMergedOcc 0
45 mol 286 unq 1 iso 0 dist 5.03123 7.3415 6.77784 8.27359 3.90927 10.3374 numMergedOcc 0
46 mol 286 unq 2 iso 0 dist 5.03123 7.3415 6.77784 8.14957 3.85003 7.62289 numMergedOcc 0
