0 mol 11 unq 0 iso 0 dist 4.61088 6.84216 9.68636 10.7734 13.8584 9.81983 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 5.54419 8.23075 6.7846 5.11617 8.4051 7.85986 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 5.54419 4.7841 8.03955 4.50066 9.83002 7.03544 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 5.54419 4.7841 8.03955 5.11617 8.4051 4.30252 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 8.34347 7.98005 12.5438 10.797 18.8417 9.82851 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 8.34347 7.98005 12.5438 10.9837 18.1487 9.11311 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 6.86465 9.23438 4.59417 10.2049 8.80614 6.41008 numMergedOcc 0
7 mol 58 unq 1 iso 0 dist 6.35756 7.17488 4.59417 5.49591 8.80614 6.41008 numMergedOcc 0
8 mol 58 unq 2 iso 0 dist 6.64012 6.79356 5.87468 5.85698 9.86039 6.41008 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 5.08437 7.92856 8.29813 14.1056 17.0262 9.90672 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 5.08437 7.92856 8.29813 14.3413 13.8815 7.55367 numMergedOcc 0
11 mol 98 unq 2 iso 0 dist 6.48948 7.92856 13.2057 14.1056 18.2936 9.90672 numMergedOcc 0
12 mol 98 unq 3 iso 0 dist 6.48948 7.92856 13.2057 14.3413 17.8091 7.55367 numMergedOcc 0
13 mol 98 unq 4 iso 0 dist 6.10456 7.92856 12.7473 14.1056 17.2253 9.90672 numMergedOcc 0
14 mol 98 unq 5 iso 0 dist 6.10456 7.92856 12.7473 14.3413 19.9118 7.55367 numMergedOcc 0
15 mol 102 unq 0 iso 0 dist 7.36792 5.54256 3.48119 4.48396 9.24642 6.07633 numMergedOcc 0
16 mol 113 unq 0 iso 0 dist 5.86073 9.59585 13.0914 8.42718 9.66219 5.35711 numMergedOcc 0
17 mol 113 unq 1 iso 0 dist 5.86073 7.02367 5.37655 7.27193 11.9334 9.62952 numMergedOcc 0
18 mol 130 unq 0 iso 0 dist 9.28393 5.92733 6.00473 7.11959 13.5511 8.00013 numMergedOcc 0
19 mol 143 unq 0 iso 0 dist 5.99315 8.64905 6.75249 10.4028 9.14266 7.2932 numMergedOcc 0
20 mol 169 unq 0 iso 0 dist 8.49164 9.37946 17.056 8.6888 14.7367 5.41121 numMergedOcc 0
21 mol 205 unq 0 iso 0 dist 7.26832 7.13783 13.3822 9.55992 13.6297 7.75318 numMergedOcc 0
22 mol 206 unq 0 iso 0 dist 8.02137 6.23183 8.20841 7.67029 12.6228 5.17607 numMergedOcc 0
23 mol 206 unq 1 iso 0 dist 7.7366 4.51255 7.83734 4.62682 11.6096 5.17607 numMergedOcc 0
24 mol 206 unq 2 iso 0 dist 9.774 6.23183 7.83734 7.67029 11.6096 5.17607 numMergedOcc 0
25 mol 232 unq 0 iso 0 dist 8.27212 8.25985 4.04428 4.9377 9.40808 9.78273 numMergedOcc 0
26 mol 256 unq 0 iso 0 dist 8.29103 4.80903 5.08421 5.28793 9.4406 4.36333 numMergedOcc 0
27 mol 256 unq 1 iso 0 dist 8.29103 4.80903 5.08421 4.99672 10.6676 6.96483 numMergedOcc 0
28 mol 258 unq 0 iso 0 dist 6.97229 5.4557 4.02333 6.93678 10.935 7.08328 numMergedOcc 0
29 mol 261 unq 0 iso 0 dist 8.45658 8.24356 11.4108 6.18925 13.1245 9.41212 numMergedOcc 0
