0 mol 16 unq 0 iso 0 dist 8.62634 6.68517 6.05535 5.65481 9.04834 4.7319 10.0048 5.37568 6.86055 7.65889 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 7.19567 6.84521 10.1001 5.84171 11.7216 5.73819 10.8355 14.5812 4.96926 6.75943 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 7.19567 8.90024 14.2671 13.9129 19.1124 8.80331 10.8355 14.5812 5.41726 6.6263 numMergedOcc 0
3 mol 43 unq 2 iso 0 dist 7.19567 8.90024 14.2671 5.84171 11.7216 6.20293 10.8355 14.5812 5.41726 6.75943 numMergedOcc 0
4 mol 43 unq 3 iso 0 dist 7.19567 6.78532 10.3556 5.84171 11.7216 8.93915 10.8355 14.5812 10.0383 6.75943 numMergedOcc 0
5 mol 43 unq 4 iso 0 dist 9.34433 6.84521 12.3867 5.84171 13.3384 5.73819 10.8355 16.4674 4.96926 6.75943 numMergedOcc 0
6 mol 43 unq 5 iso 0 dist 9.34433 8.90024 12.0037 13.9129 19.9708 8.80331 10.8355 16.4674 5.41726 6.6263 numMergedOcc 0
7 mol 43 unq 6 iso 0 dist 9.34433 8.90024 12.0037 5.84171 13.3384 6.20293 10.8355 16.4674 5.41726 6.75943 numMergedOcc 0
8 mol 43 unq 7 iso 0 dist 9.34433 6.78532 6.9067 5.84171 13.3384 8.93915 10.8355 16.4674 10.0383 6.75943 numMergedOcc 0
9 mol 64 unq 0 iso 0 dist 8.71324 9.56181 9.73304 7.70414 9.10915 9.67592 10.7474 6.24019 5.16015 9.86334 numMergedOcc 0
10 mol 64 unq 1 iso 0 dist 9.5663 9.56181 5.59762 7.70414 5.54343 9.67592 10.7474 5.18166 5.16015 9.86334 numMergedOcc 0
11 mol 72 unq 0 iso 0 dist 8.06901 5.48831 5.86484 13.0773 13.6843 9.96708 11.3204 12.8044 7.47371 7.12321 numMergedOcc 0
12 mol 72 unq 1 iso 0 dist 8.06901 5.48831 5.86484 10.5933 15.4072 9.78528 11.3204 12.8044 7.47371 6.21799 numMergedOcc 0
13 mol 72 unq 2 iso 0 dist 8.06901 5.48831 5.86484 10.5933 15.4072 9.78528 12.3271 15.3998 9.67587 5.03251 numMergedOcc 0
14 mol 72 unq 3 iso 0 dist 8.06901 5.48831 5.86484 10.5933 15.4072 9.78528 9.20886 12.4898 7.07356 7.66093 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 8.98532 8.3558 5.1767 15.1474 10.9081 7.4729 11.6676 5.99325 4.46885 8.3773 numMergedOcc 0
16 mol 95 unq 0 iso 0 dist 5.84349 7.90775 4.33346 4.16047 8.26838 9.03572 8.57607 8.32734 4.99174 8.27883 numMergedOcc 0
17 mol 95 unq 1 iso 0 dist 5.84349 7.90775 4.33346 4.16047 8.26838 9.03572 6.1991 4.79063 4.46005 5.75428 numMergedOcc 0
18 mol 95 unq 2 iso 0 dist 5.84349 7.90775 4.33346 4.16047 8.26838 9.03572 5.96246 4.05985 8.28518 8.57395 numMergedOcc 0
19 mol 95 unq 3 iso 0 dist 5.84349 7.90775 4.33346 4.16047 8.26838 9.03572 10.1197 12.6917 15.917 9.85409 numMergedOcc 0
20 mol 134 unq 0 iso 0 dist 6.7402 8.84656 8.44345 10.879 13.403 6.37586 14.395 17.5949 10.8635 9.33094 numMergedOcc 0
21 mol 134 unq 1 iso 0 dist 6.7402 8.84656 8.44345 16.7911 18.124 9.71307 18.4308 22.2853 15.0225 9.1998 numMergedOcc 0
22 mol 134 unq 2 iso 0 dist 6.7402 8.84656 8.44345 16.7911 18.124 9.71307 14.395 17.5949 10.8635 8.69531 numMergedOcc 0
23 mol 134 unq 3 iso 0 dist 6.7402 4.9155 7.46245 10.879 13.403 6.49416 14.395 17.5949 12.3479 9.33094 numMergedOcc 0
24 mol 143 unq 0 iso 0 dist 8.80779 7.73769 7.64386 7.36837 12.5183 5.99315 11.8017 19.1677 13.1926 7.36975 numMergedOcc 0
25 mol 143 unq 1 iso 0 dist 8.80779 7.73769 7.64386 7.36837 12.5183 5.99315 12.3347 14.9585 7.39837 5.40637 numMergedOcc 0
26 mol 178 unq 0 iso 0 dist 9.3355 8.04723 13.6129 14.4072 18.3231 6.69288 10.9114 11.8474 6.42973 7.06025 numMergedOcc 0
27 mol 236 unq 0 iso 0 dist 5.46484 8.95071 6.49831 12.8358 12.2331 6.27581 14.8517 15.2955 10.5774 9.3206 numMergedOcc 0
28 mol 243 unq 0 iso 0 dist 7.72368 7.80612 6.64693 9.62983 13.8538 8.23192 12.6512 11.8086 5.71505 8.69318 numMergedOcc 0
