0 mol 2 unq 0 iso 0 dist 7.29506 4.8518 5.74846 10.8581 13.5077 9.71702 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 7.18148 7.50891 6.89022 5.0478 10.1455 6.32568 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 8.90147 7.57949 6.10199 10.925 3.68327 9.57333 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 6.9741 5.27239 6.10199 10.3434 3.68327 9.57333 numMergedOcc 0
4 mol 141 unq 0 iso 0 dist 5.35509 12.9921 8.56285 5.80081 3.80087 7.90709 numMergedOcc 0
5 mol 141 unq 1 iso 0 dist 5.35509 12.9921 8.56285 6.49728 3.80763 9.03842 numMergedOcc 0
6 mol 148 unq 0 iso 0 dist 8.99827 9.46631 8.88297 15.0742 11.1423 8.03721 numMergedOcc 0
7 mol 148 unq 1 iso 0 dist 8.99827 9.46631 8.88297 16.156 9.00149 9.87021 numMergedOcc 0
8 mol 148 unq 2 iso 0 dist 8.99827 9.46631 8.88297 15.6114 10.5863 7.34023 numMergedOcc 0
9 mol 150 unq 0 iso 0 dist 8.97634 9.47461 8.82984 15.2447 11.289 8.13558 numMergedOcc 0
10 mol 150 unq 1 iso 0 dist 8.97634 9.47461 8.82984 16.255 9.04793 9.96938 numMergedOcc 0
11 mol 150 unq 2 iso 0 dist 8.97634 9.47461 8.82984 15.6194 10.5688 7.35268 numMergedOcc 0
12 mol 182 unq 0 iso 0 dist 7.01577 4.11556 8.58391 8.04856 3.73864 9.48378 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 5.84589 12.3601 8.04472 17.6212 12.8344 8.38137 numMergedOcc 0
14 mol 184 unq 1 iso 0 dist 7.79098 6.17909 8.93083 5.11863 4.12242 9.02161 numMergedOcc 0
15 mol 184 unq 2 iso 0 dist 7.79098 9.54933 5.62851 5.11863 4.12242 8.38137 numMergedOcc 0
16 mol 184 unq 3 iso 0 dist 6.30144 6.8573 8.93083 5.92785 4.12242 9.02161 numMergedOcc 0
17 mol 184 unq 4 iso 0 dist 6.30144 5.66314 5.62851 5.92785 4.12242 8.38137 numMergedOcc 0
18 mol 197 unq 0 iso 0 dist 6.05447 7.7023 9.10527 15.1055 16.1513 8.43104 numMergedOcc 0
19 mol 197 unq 1 iso 0 dist 6.05447 7.7023 9.10527 13.3338 11.1658 9.13452 numMergedOcc 0
20 mol 210 unq 0 iso 0 dist 9.72463 9.27683 9.41473 10.889 5.63245 8.37183 numMergedOcc 0
21 mol 210 unq 1 iso 0 dist 9.72463 9.27683 9.41473 15.0285 12.1701 6.6588 numMergedOcc 0
22 mol 254 unq 0 iso 0 dist 8.4346 13.8821 6.56151 9.00866 4.4384 9.43169 numMergedOcc 0
23 mol 254 unq 1 iso 0 dist 8.4346 10.4797 6.58752 9.00866 4.4384 5.9438 numMergedOcc 0
24 mol 254 unq 2 iso 0 dist 7.97728 13.8821 8.3417 9.00866 6.09569 9.43169 numMergedOcc 0
25 mol 257 unq 0 iso 0 dist 8.18447 5.23923 8.86142 10.8996 8.63927 8.48733 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 9.02396 13.6384 8.53393 11.1063 4.60397 9.60449 numMergedOcc 0
27 mol 266 unq 1 iso 0 dist 7.48115 13.6384 7.24165 11.1063 5.26919 9.60449 numMergedOcc 0
28 mol 278 unq 0 iso 0 dist 9.24462 7.87625 4.76359 15.0313 6.15148 9.51705 numMergedOcc 0
29 mol 278 unq 1 iso 0 dist 6.01365 5.81275 4.76359 8.71212 6.15148 9.51705 numMergedOcc 0
