0 mol 11 unq 0 iso 0 dist 9.64228 7.95375 8.21795 8.85204 4.69897 11.0428 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 8.27307 9.40686 11.8246 5.38363 8.67853 14.1026 numMergedOcc 0
2 mol 69 unq 1 iso 0 dist 6.92837 9.40686 3.85648 5.38363 10.8149 14.1026 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 8.30653 9.29166 15.4825 9.87737 5.78087 15.5765 numMergedOcc 0
4 mol 70 unq 1 iso 0 dist 8.30653 9.29166 15.4825 6.7303 6.10128 11.9297 numMergedOcc 0
5 mol 70 unq 2 iso 0 dist 8.63742 9.41961 9.58894 7.34645 3.80229 11.9297 numMergedOcc 0
6 mol 70 unq 3 iso 0 dist 6.91739 9.29166 9.58894 9.87737 6.64078 15.5765 numMergedOcc 0
7 mol 70 unq 4 iso 0 dist 6.91739 9.29166 9.58894 6.7303 3.80229 11.9297 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 9.96446 7.69672 12.6706 4.96173 11.3522 10.7169 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 6.70686 7.69672 8.52106 4.96173 10.0591 10.7169 numMergedOcc 0
10 mol 111 unq 0 iso 0 dist 6.34542 9.76075 6.3561 9.83758 6.34994 12.2767 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 5.06555 6.21509 4.98499 8.0889 5.61274 3.47821 numMergedOcc 0
12 mol 142 unq 0 iso 0 dist 4.93681 7.97859 6.05056 6.4119 4.05822 3.06927 numMergedOcc 0
13 mol 142 unq 1 iso 0 dist 9.57509 9.28039 6.62272 8.40522 9.082 3.06927 numMergedOcc 0
14 mol 158 unq 0 iso 0 dist 9.66837 8.71292 10.2936 7.37255 7.72421 10.9272 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 6.28961 6.58855 4.19562 7.07933 5.38859 8.64393 numMergedOcc 0
16 mol 206 unq 0 iso 0 dist 9.90891 6.28518 15.9553 7.54599 9.76121 10.7204 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 8.14464 9.7268 12.2034 8.81424 9.76678 3.10571 numMergedOcc 0
18 mol 225 unq 1 iso 0 dist 8.14464 9.7268 12.2034 9.60949 5.41981 16.4394 numMergedOcc 0
19 mol 225 unq 2 iso 0 dist 9.93754 9.7268 7.96183 8.81424 9.72811 3.10571 numMergedOcc 0
20 mol 225 unq 3 iso 0 dist 9.93754 9.7268 7.96183 9.60949 19.3511 16.4394 numMergedOcc 0
21 mol 235 unq 0 iso 0 dist 9.03917 7.79729 8.98913 7.8548 4.67058 5.70734 numMergedOcc 0
22 mol 235 unq 1 iso 0 dist 6.56775 7.79729 10.8002 7.8548 10.28 5.70734 numMergedOcc 0
23 mol 261 unq 0 iso 0 dist 9.80409 9.00616 15.4874 8.55479 11.4108 16.5658 numMergedOcc 0
24 mol 261 unq 1 iso 0 dist 9.80409 6.35699 13.3429 8.55479 11.4108 12.8509 numMergedOcc 0
25 mol 266 unq 0 iso 0 dist 6.95233 9.85095 5.60582 7.96613 14.5358 16.1366 numMergedOcc 0
26 mol 266 unq 1 iso 0 dist 6.95233 8.25191 10.3169 7.96613 14.5358 9.94662 numMergedOcc 0
27 mol 266 unq 2 iso 0 dist 6.95233 7.35056 9.69688 7.96613 14.5358 10.4118 numMergedOcc 0
28 mol 266 unq 3 iso 0 dist 9.61741 9.85095 17.1864 7.96613 13.7682 16.1366 numMergedOcc 0
29 mol 266 unq 4 iso 0 dist 9.61741 8.25191 15.5379 7.96613 13.7682 9.94662 numMergedOcc 0
30 mol 266 unq 5 iso 0 dist 9.61741 7.35056 12.4229 7.96613 13.7682 10.4118 numMergedOcc 0
31 mol 266 unq 6 iso 0 dist 5.61056 9.85095 12.5903 7.96613 11.879 16.1366 numMergedOcc 0
32 mol 266 unq 7 iso 0 dist 5.61056 8.25191 9.37668 7.96613 11.879 9.94662 numMergedOcc 0
33 mol 266 unq 8 iso 0 dist 5.61056 7.35056 6.29234 7.96613 11.879 10.4118 numMergedOcc 0
34 mol 277 unq 0 iso 0 dist 9.38793 7.89017 13.9139 7.05489 9.94225 6.54549 numMergedOcc 0
