0 mol 19 unq 0 iso 0 dist 7.09123 6.79758 4.44575 5.21676 10.0157 7.78708 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 7.09123 6.79758 4.44575 7.65931 10.9975 7.84393 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 7.09123 8.96529 6.93144 11.5235 12.7771 8.18518 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 9.81779 7.49678 8.22614 5.50758 13.8639 8.89758 numMergedOcc 0
4 mol 53 unq 0 iso 0 dist 9.57346 6.26613 7.8083 6.5074 13.6182 8.62669 numMergedOcc 0
5 mol 55 unq 0 iso 0 dist 9.81486 8.70819 4.85299 8.33206 8.75995 6.25914 numMergedOcc 0
6 mol 55 unq 1 iso 0 dist 9.81486 8.70819 4.85299 4.83051 6.0933 6.03755 numMergedOcc 0
7 mol 55 unq 2 iso 0 dist 9.35067 8.49449 7.54681 5.53748 8.95052 6.25914 numMergedOcc 0
8 mol 55 unq 3 iso 0 dist 9.35067 8.49449 7.54681 10.307 11.7575 6.03755 numMergedOcc 0
9 mol 55 unq 4 iso 0 dist 8.33457 6.45963 10.6445 4.53728 12.6266 6.25914 numMergedOcc 0
10 mol 55 unq 5 iso 0 dist 8.33457 6.45963 10.6445 5.70356 11.8166 6.03755 numMergedOcc 0
11 mol 55 unq 6 iso 0 dist 8.87502 8.70819 10.6445 8.33206 12.6266 6.25914 numMergedOcc 0
12 mol 55 unq 7 iso 0 dist 8.87502 8.70819 10.6445 4.83051 11.8166 6.03755 numMergedOcc 0
13 mol 68 unq 0 iso 0 dist 7.61029 5.04007 10.5254 5.82571 13.3771 6.87176 numMergedOcc 0
14 mol 68 unq 1 iso 0 dist 7.61029 5.04007 10.5254 8.48982 11.4345 7.45675 numMergedOcc 0
15 mol 68 unq 2 iso 0 dist 7.61029 6.60395 13.1001 5.82571 13.3771 5.57389 numMergedOcc 0
16 mol 76 unq 0 iso 0 dist 8.65864 8.08674 7.90785 9.08836 12.342 4.83274 numMergedOcc 0
17 mol 76 unq 1 iso 0 dist 8.65864 8.33694 15.3489 9.08836 12.342 7.89214 numMergedOcc 0
18 mol 132 unq 0 iso 0 dist 9.24867 8.97036 8.47722 13.8837 14.8583 6.495 numMergedOcc 0
19 mol 132 unq 1 iso 0 dist 9.24867 8.97036 8.47722 14.8844 17.8538 9.43748 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 5.66981 7.88346 4.14823 12.628 11.3052 7.5984 numMergedOcc 0
21 mol 143 unq 1 iso 0 dist 5.66981 9.6112 11.7354 8.99682 12.8356 5.30872 numMergedOcc 0
22 mol 173 unq 0 iso 0 dist 9.90421 7.71773 7.82577 8.14671 15.4988 8.84671 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 9.58058 8.9867 12.4293 5.22923 10.1325 6.86297 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 8.70984 5.50553 5.41409 7.08073 8.26503 7.46199 numMergedOcc 0
