0 mol 53 unq 0 iso 0 dist 7.57227 7.77338 9.01319 6.27107 12.1771 9.90852 numMergedOcc 0
1 mol 53 unq 1 iso 0 dist 7.57227 7.77338 9.01319 5.01743 8.79235 9.31516 numMergedOcc 0
2 mol 104 unq 0 iso 0 dist 8.44593 7.43351 10.4022 12.6128 18.2976 8.73137 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 8.58344 6.61966 5.81849 8.09038 12.3882 7.14258 numMergedOcc 0
4 mol 119 unq 1 iso 0 dist 5.68879 6.61966 5.7998 8.09038 11.495 7.14258 numMergedOcc 0
5 mol 130 unq 0 iso 0 dist 6.5114 7.04929 7.55204 9.3176 7.15213 6.98077 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 9.76501 8.20024 4.25746 7.21648 10.4827 6.45477 numMergedOcc 0
7 mol 148 unq 0 iso 0 dist 8.80448 8.63766 7.06829 13.17 14.0044 8.3656 numMergedOcc 0
8 mol 148 unq 1 iso 0 dist 8.80448 8.42082 13.2635 8.93277 16.3837 5.20262 numMergedOcc 0
9 mol 150 unq 0 iso 0 dist 8.78855 8.7107 7.13108 13.1979 14.0624 8.44633 numMergedOcc 0
10 mol 150 unq 1 iso 0 dist 8.78855 8.47493 13.2655 8.91488 16.3471 5.21792 numMergedOcc 0
11 mol 192 unq 0 iso 0 dist 5.99974 7.00749 8.15721 8.02616 5.08603 9.19818 numMergedOcc 0
12 mol 211 unq 0 iso 0 dist 5.02094 6.32818 7.02917 4.67058 9.66323 8.94017 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 5.2376 8.77267 9.16344 7.99029 12.0387 8.15255 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 4.70107 8.78029 10.4744 14.9104 17.4537 8.9327 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 9.94532 4.49691 10.2094 5.97248 14.9683 7.88296 numMergedOcc 0
16 mol 260 unq 1 iso 0 dist 9.94532 4.49691 10.2094 7.22322 17.0487 9.47149 numMergedOcc 0
17 mol 282 unq 0 iso 0 dist 7.28238 8.37963 11.1224 7.17376 13.4896 9.33418 numMergedOcc 0
18 mol 282 unq 1 iso 0 dist 7.3389 8.37963 7.59308 7.17376 6.00439 9.33418 numMergedOcc 0
