0 mol 10 unq 0 iso 0 dist 6.31531 4.64029 9.29504 12.236 15.0188 7.83083 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 6.31531 4.64029 9.29504 10.7719 12.4341 6.90469 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 9.76497 5.38502 8.6232 8.7443 3.36756 5.92388 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 9.50049 8.14608 5.52834 13.3932 4.62559 7.53194 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.54999 10.5856 7.21995 9.72036 3.83842 8.81562 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 7.99735 13.11 9.53081 16.4592 13.4515 5.43913 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 7.99735 13.11 9.53081 20.7322 17.6258 8.26877 numMergedOcc 0
7 mol 48 unq 2 iso 0 dist 9.7516 4.99432 9.53081 9.48328 13.4515 5.43913 numMergedOcc 0
8 mol 48 unq 3 iso 0 dist 9.7516 4.99432 9.53081 11.5119 17.6258 8.26877 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 7.63813 11.1941 7.48127 14.3384 8.58474 5.91098 numMergedOcc 0
10 mol 78 unq 0 iso 0 dist 6.09318 7.90823 9.86325 10.0726 7.86077 6.11101 numMergedOcc 0
11 mol 83 unq 0 iso 0 dist 9.90769 15.5212 7.2118 13.9691 4.48523 7.69755 numMergedOcc 0
12 mol 90 unq 0 iso 0 dist 9.69413 7.89197 9.06641 6.77993 6.65219 8.63446 numMergedOcc 0
13 mol 96 unq 0 iso 0 dist 9.25941 6.04753 8.9056 7.22615 11.9221 8.79886 numMergedOcc 0
14 mol 116 unq 0 iso 0 dist 5.58346 8.38134 6.53824 9.61657 4.82514 9.12145 numMergedOcc 0
15 mol 116 unq 1 iso 0 dist 5.58346 8.38134 6.53824 10.4344 5.7646 8.11048 numMergedOcc 0
16 mol 116 unq 2 iso 0 dist 7.09179 8.38134 6.61973 9.61657 8.63935 9.12145 numMergedOcc 0
17 mol 116 unq 3 iso 0 dist 7.09179 8.38134 6.61973 10.4344 4.10222 8.11048 numMergedOcc 0
18 mol 116 unq 4 iso 0 dist 6.24768 5.88698 6.53824 7.65919 4.82514 9.12145 numMergedOcc 0
19 mol 116 unq 5 iso 0 dist 6.24768 5.88698 6.53824 11.0638 5.7646 8.11048 numMergedOcc 0
20 mol 116 unq 6 iso 0 dist 9.31875 5.88698 6.61973 7.65919 8.63935 9.12145 numMergedOcc 0
21 mol 116 unq 7 iso 0 dist 9.31875 5.88698 6.61973 11.0638 4.10222 8.11048 numMergedOcc 0
22 mol 124 unq 0 iso 0 dist 8.45451 12.0208 7.18976 8.06631 5.3096 8.50362 numMergedOcc 0
23 mol 133 unq 0 iso 0 dist 8.61918 13.2228 5.79195 6.01995 4.63862 9.35049 numMergedOcc 0
24 mol 137 unq 0 iso 0 dist 9.85023 11.3759 9.1425 14.4041 5.20208 9.63793 numMergedOcc 0
25 mol 157 unq 0 iso 0 dist 6.97303 6.72897 6.8976 8.97914 5.07066 8.36016 numMergedOcc 0
26 mol 157 unq 1 iso 0 dist 9.37761 7.17345 6.8976 12.4033 5.07066 8.36016 numMergedOcc 0
27 mol 198 unq 0 iso 0 dist 9.65489 7.26405 8.51153 13.5491 7.14873 7.94413 numMergedOcc 0
28 mol 258 unq 0 iso 0 dist 6.77021 5.83092 8.58092 4.98907 5.05766 5.94328 numMergedOcc 0
29 mol 258 unq 1 iso 0 dist 6.77021 5.09024 7.40014 4.98907 5.05766 7.91978 numMergedOcc 0
30 mol 266 unq 0 iso 0 dist 8.65743 5.36882 9.62494 5.28746 4.39553 6.48382 numMergedOcc 0
31 mol 274 unq 0 iso 0 dist 8.95153 7.77559 9.34051 5.77565 4.66969 8.67957 numMergedOcc 0
32 mol 294 unq 0 iso 0 dist 5.25409 4.06072 6.37998 7.58948 3.33848 7.94656 numMergedOcc 0
33 mol 294 unq 1 iso 0 dist 8.90069 10.2133 9.22572 14.433 7.55679 8.32582 numMergedOcc 0
