0 mol 7 unq 0 iso 0 dist 8.48743 9.17764 17.04 17.5844 24.8415 9.97624 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 9.9795 5.20528 9.29301 9.30804 13.9302 6.05495 numMergedOcc 0
2 mol 133 unq 0 iso 0 dist 7.5055 8.91143 5.81428 14.7258 13.0033 8.21165 numMergedOcc 0
3 mol 133 unq 1 iso 0 dist 8.66715 9.29665 17.3196 13.6142 22.2543 6.87262 numMergedOcc 0
4 mol 133 unq 2 iso 0 dist 9.00172 9.29665 16.1302 13.6142 20.5727 6.87262 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 4.68975 7.85849 4.60632 14.3338 12.7291 8.55616 numMergedOcc 0
6 mol 134 unq 1 iso 0 dist 4.68975 7.85849 4.60632 13.386 12.0514 8.73604 numMergedOcc 0
7 mol 134 unq 2 iso 0 dist 8.84656 7.85849 5.29786 14.3338 10.9613 8.55616 numMergedOcc 0
8 mol 134 unq 3 iso 0 dist 8.84656 7.85849 5.29786 13.386 5.42582 8.73604 numMergedOcc 0
9 mol 134 unq 4 iso 0 dist 4.9155 7.85849 5.71679 14.3338 10.9685 8.55616 numMergedOcc 0
10 mol 134 unq 5 iso 0 dist 4.9155 7.85849 5.71679 13.386 8.6355 8.73604 numMergedOcc 0
11 mol 134 unq 6 iso 0 dist 9.42271 6.08299 5.71679 5.2893 10.9685 8.55616 numMergedOcc 0
12 mol 134 unq 7 iso 0 dist 9.42271 6.08299 5.71679 11.8215 8.6355 8.73604 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.52413 8.34668 15.1778 4.34714 13.3601 9.84492 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 6.0639 6.0685 7.94756 9.48246 14.4305 8.97471 numMergedOcc 0
15 mol 186 unq 2 iso 0 dist 6.91355 6.0685 7.02735 9.48246 14.4226 8.97471 numMergedOcc 0
16 mol 227 unq 0 iso 0 dist 9.66521 9.45021 9.98177 14.171 16.9005 9.28891 numMergedOcc 0
17 mol 235 unq 0 iso 0 dist 5.60236 8.08581 5.5163 12.4324 10.4621 6.54825 numMergedOcc 0
18 mol 235 unq 1 iso 0 dist 9.03917 5.98104 5.5163 4.25998 10.4621 6.54825 numMergedOcc 0
19 mol 235 unq 2 iso 0 dist 6.56775 5.98104 7.77516 4.25998 5.65339 6.54825 numMergedOcc 0
20 mol 235 unq 3 iso 0 dist 6.45574 4.46919 7.60081 5.61388 8.21247 7.95766 numMergedOcc 0
21 mol 265 unq 0 iso 0 dist 8.49415 7.87337 13.6299 5.82541 12.4545 5.40318 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 9.79022 6.59092 7.81483 5.35494 10.3657 8.85779 numMergedOcc 0
23 mol 277 unq 0 iso 0 dist 9.38793 7.64361 16.4697 6.75676 14.4381 6.43034 numMergedOcc 0
24 mol 284 unq 0 iso 0 dist 9.98268 6.53769 15.3251 4.89439 14.5191 6.61376 numMergedOcc 0
25 mol 284 unq 1 iso 0 dist 6.83147 6.53769 10.6664 4.89439 11.1846 6.61376 numMergedOcc 0
26 mol 284 unq 2 iso 0 dist 7.43241 6.53769 4.50325 4.89439 4.86729 6.61376 numMergedOcc 0
