0 mol 25 unq 0 iso 0 dist 9.88453 5.37485 9.10473 10.2678 4.88903 9.33067 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 8.51894 6.50345 9.13371 10.7932 4.54783 8.3263 numMergedOcc 0
2 mol 69 unq 1 iso 0 dist 8.27592 6.50345 9.43916 10.7932 5.98534 8.3263 numMergedOcc 0
3 mol 71 unq 0 iso 0 dist 7.75237 9.86951 8.23389 11.0315 5.68539 4.74654 numMergedOcc 0
4 mol 170 unq 0 iso 0 dist 5.94075 5.37396 8.95292 14.5228 15.6007 9.66676 numMergedOcc 0
5 mol 192 unq 0 iso 0 dist 7.72242 10.2336 7.578 13.9805 8.77024 7.75405 numMergedOcc 0
6 mol 192 unq 1 iso 0 dist 7.72242 10.2336 7.578 17.452 13.9721 7.49971 numMergedOcc 0
7 mol 210 unq 0 iso 0 dist 7.68078 4.3844 8.36019 9.95873 5.14472 9.07676 numMergedOcc 0
8 mol 210 unq 1 iso 0 dist 7.68078 4.3844 8.36019 8.94889 12.3142 9.71107 numMergedOcc 0
9 mol 210 unq 2 iso 0 dist 7.68078 6.85132 7.30805 9.95873 5.14472 6.2401 numMergedOcc 0
10 mol 210 unq 3 iso 0 dist 7.68078 6.85132 7.30805 8.94889 12.3142 9.7449 numMergedOcc 0
11 mol 218 unq 0 iso 0 dist 5.98076 6.13691 8.38813 9.13014 12.9434 9.65132 numMergedOcc 0
12 mol 235 unq 0 iso 0 dist 7.52696 7.4921 4.36956 7.30003 4.81997 7.93194 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 7.31087 7.64621 8.9327 10.8816 6.78632 6.93465 numMergedOcc 0
14 mol 239 unq 1 iso 0 dist 4.21935 8.15025 7.69491 16.3204 16.88 9.993 numMergedOcc 0
15 mol 247 unq 0 iso 0 dist 9.48468 16.1686 7.95874 11.9675 6.27569 9.07781 numMergedOcc 0
16 mol 247 unq 1 iso 0 dist 9.48468 16.1686 7.95874 16.3473 8.04601 6.84199 numMergedOcc 0
17 mol 249 unq 0 iso 0 dist 6.04688 6.46947 9.1515 5.70674 4.88298 8.56493 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 9.42812 17.13 8.18813 13.9579 5.95045 6.42951 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 8.66917 6.23517 8.16952 10.9187 12.9291 8.30375 numMergedOcc 0
20 mol 279 unq 1 iso 0 dist 8.36655 5.03816 8.9352 11.6898 7.78018 8.34313 numMergedOcc 0
21 mol 279 unq 2 iso 0 dist 8.76889 7.51644 5.8845 13.774 5.38411 8.34313 numMergedOcc 0
22 mol 279 unq 3 iso 0 dist 7.04397 3.75346 5.8845 10.4088 5.38411 8.34313 numMergedOcc 0
23 mol 282 unq 0 iso 0 dist 8.3398 5.15758 9.33418 11.6683 8.33363 8.66659 numMergedOcc 0
24 mol 283 unq 0 iso 0 dist 6.15136 5.83652 5.05882 6.93798 4.67572 5.32876 numMergedOcc 0
25 mol 286 unq 0 iso 0 dist 8.30708 6.2267 8.09566 11.2127 8.52402 5.58968 numMergedOcc 0
26 mol 286 unq 1 iso 0 dist 8.9718 6.2267 5.6343 11.2127 4.55196 5.58968 numMergedOcc 0
