0 mol 1 unq 0 iso 0 dist 8.3673 12.6995 7.27254 14.0625 6.27888 8.26708 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.3673 12.6995 7.27254 9.48433 4.50502 6.09918 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 5.14123 3.97129 7.17026 6.47132 6.08003 8.64015 numMergedOcc 0
3 mol 143 unq 0 iso 0 dist 9.11877 11.6394 8.612 11.9411 4.78563 7.25673 numMergedOcc 0
4 mol 152 unq 0 iso 0 dist 9.77567 9.29952 7.1069 14.2479 4.94983 8.35555 numMergedOcc 0
5 mol 158 unq 0 iso 0 dist 6.81248 6.57446 6.11331 12.8515 13.7172 7.88319 numMergedOcc 0
6 mol 159 unq 0 iso 0 dist 9.50607 8.72613 6.07821 13.1289 4.48323 7.25742 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 7.44523 11.4968 7.04815 15.4026 13.6744 9.83476 numMergedOcc 0
8 mol 186 unq 1 iso 0 dist 8.30899 10.1012 8.17226 14.5703 8.0472 7.28841 numMergedOcc 0
9 mol 222 unq 0 iso 0 dist 9.06892 12.1295 7.97027 17.0574 9.01393 9.2581 numMergedOcc 0
10 mol 222 unq 1 iso 0 dist 9.06892 12.1295 7.97027 20.6248 13.3586 9.62632 numMergedOcc 0
11 mol 222 unq 2 iso 0 dist 9.06892 12.1295 7.97027 15.4985 8.84507 7.862 numMergedOcc 0
12 mol 222 unq 3 iso 0 dist 9.1027 4.72931 6.81955 10.8934 6.25425 9.2581 numMergedOcc 0
13 mol 222 unq 4 iso 0 dist 9.1027 4.72931 6.81955 13.2149 5.16212 9.62632 numMergedOcc 0
14 mol 222 unq 5 iso 0 dist 9.1027 4.72931 6.81955 12.568 8.67203 7.862 numMergedOcc 0
15 mol 222 unq 6 iso 0 dist 8.54373 4.72931 4.9876 10.8934 5.64455 9.2581 numMergedOcc 0
16 mol 222 unq 7 iso 0 dist 8.54373 4.72931 4.9876 13.2149 5.9478 9.62632 numMergedOcc 0
17 mol 222 unq 8 iso 0 dist 8.54373 4.72931 4.9876 12.568 6.02502 7.862 numMergedOcc 0
18 mol 225 unq 0 iso 0 dist 6.20862 12.4669 9.87668 18.0717 17.3148 8.87609 numMergedOcc 0
19 mol 225 unq 1 iso 0 dist 7.27888 8.78638 9.87668 17.4119 17.3148 8.87609 numMergedOcc 0
20 mol 225 unq 2 iso 0 dist 9.0254 8.78638 8.42121 17.4119 13.3773 8.87609 numMergedOcc 0
21 mol 225 unq 3 iso 0 dist 4.58113 6.63243 4.98402 14.1237 9.9875 8.87609 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 8.60476 5.91119 7.59696 8.52422 10.0918 7.67245 numMergedOcc 0
23 mol 278 unq 1 iso 0 dist 8.60476 5.91119 7.59696 9.78354 6.48173 9.12395 numMergedOcc 0
