0 mol 7 unq 0 iso 0 dist 8.48743 9.17764 17.04 5.1316 13.2107 6.14469 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.90473 4.9737 5.81765 6.09666 7.36856 6.93197 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 9.9795 5.20528 9.29301 12.9555 14.4725 9.66222 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 9.96446 6.15011 8.70803 8.51558 5.9465 6.77241 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 6.70686 6.15011 8.87994 8.51558 6.97962 6.77241 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 9.61812 9.58313 4.86592 7.76066 7.80975 5.75014 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 8.86938 9.86487 18.0868 11.57 20.2471 7.80873 numMergedOcc 0
7 mol 112 unq 1 iso 0 dist 7.42474 9.86487 5.76986 11.57 9.28592 7.80873 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 8.66715 9.29665 17.3196 5.5502 12.817 6.84835 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 8.66715 9.29665 17.3196 8.24649 16.1663 8.42748 numMergedOcc 0
10 mol 133 unq 2 iso 0 dist 9.00172 9.29665 16.1302 5.5502 14.4764 6.84835 numMergedOcc 0
11 mol 133 unq 3 iso 0 dist 9.00172 9.29665 16.1302 8.24649 12.5696 8.42748 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 4.68975 7.85849 4.60632 6.64576 5.83771 6.40575 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 8.84656 7.85849 5.29786 6.64576 10.7586 6.40575 numMergedOcc 0
14 mol 134 unq 2 iso 0 dist 4.9155 7.85849 5.71679 6.64576 7.80532 6.40575 numMergedOcc 0
15 mol 134 unq 3 iso 0 dist 9.42271 6.08299 5.71679 5.87436 7.80532 6.40575 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 6.09874 9.01017 6.06566 5.06341 6.22122 7.32087 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 8.27794 6.02094 10.2585 4.80772 11.3325 5.94379 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 9.52413 8.76308 8.14815 9.75326 9.19 6.21159 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 5.60236 8.08581 5.5163 5.86896 6.36341 6.94789 numMergedOcc 0
20 mol 235 unq 1 iso 0 dist 9.03917 5.98104 5.5163 4.88651 6.36341 6.94789 numMergedOcc 0
21 mol 235 unq 2 iso 0 dist 6.56775 5.98104 7.77516 4.88651 6.21292 6.94789 numMergedOcc 0
22 mol 265 unq 0 iso 0 dist 8.49415 7.87337 13.6299 4.80754 13.0923 8.984 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 6.95233 8.31182 9.2768 7.30886 10.7037 7.00243 numMergedOcc 0
24 mol 266 unq 1 iso 0 dist 9.61741 8.31182 5.82477 7.30886 10.0654 7.00243 numMergedOcc 0
25 mol 266 unq 2 iso 0 dist 5.61056 8.31182 7.15796 7.30886 10.6338 7.00243 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 9.13226 6.74022 5.29529 8.85159 9.85289 6.88827 numMergedOcc 0
27 mol 274 unq 1 iso 0 dist 9.13226 6.74022 5.29529 9.16187 14.1515 9.16942 numMergedOcc 0
28 mol 277 unq 0 iso 0 dist 9.38793 7.64361 16.4697 9.95264 15.2518 8.20644 numMergedOcc 0
29 mol 277 unq 1 iso 0 dist 7.151 6.71956 6.28695 7.01915 10.5329 8.20644 numMergedOcc 0
30 mol 277 unq 2 iso 0 dist 8.53324 6.71956 4.37645 7.01915 12.1618 8.20644 numMergedOcc 0
31 mol 277 unq 3 iso 0 dist 7.23956 6.71956 7.70529 7.01915 10.8214 8.20644 numMergedOcc 0
32 mol 280 unq 0 iso 0 dist 6.52188 9.35785 10.173 5.51019 9.57924 6.73712 numMergedOcc 0
33 mol 284 unq 0 iso 0 dist 9.98268 6.53769 15.3251 10.1686 19.341 7.34931 numMergedOcc 0
34 mol 284 unq 1 iso 0 dist 6.83147 6.53769 10.6664 10.1686 14.5221 7.34931 numMergedOcc 0
35 mol 284 unq 2 iso 0 dist 7.43241 6.53769 4.50325 10.1686 6.78191 7.34931 numMergedOcc 0
36 mol 287 unq 0 iso 0 dist 7.95849 8.25538 13.2859 7.64544 13.0847 6.95912 numMergedOcc 0
37 mol 288 unq 0 iso 0 dist 7.95849 8.25538 13.2859 7.64544 13.0847 6.95912 numMergedOcc 0
38 mol 289 unq 0 iso 0 dist 7.95849 8.25538 13.2859 7.64544 13.0847 6.95912 numMergedOcc 0
