0 mol 43 unq 0 iso 0 dist 8.90024 9.35453 13.5667 13.9129 8.80331 21.0357 12.664 9.83618 20.2082 10.4442 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 8.90024 9.35453 13.5667 5.84171 6.20293 14.0799 12.664 9.83618 20.2082 9.49077 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 9.9795 5.20528 9.29301 9.53239 7.97049 9.82915 5.84688 9.47876 10.0297 7.98917 numMergedOcc 0
3 mol 85 unq 1 iso 0 dist 9.9795 5.20528 9.29301 13.0232 6.19965 12.0078 5.84688 9.47876 10.0297 11.6116 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 6.43255 9.88541 9.29894 6.80429 8.69985 12.4099 9.77909 5.87358 14.9452 9.46098 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 8.84656 7.85849 5.29786 10.879 6.37586 6.23142 13.386 5.42582 8.73604 5.41704 numMergedOcc 0
6 mol 134 unq 1 iso 0 dist 8.84656 7.85849 5.29786 16.7911 9.71307 9.94764 13.386 5.42582 8.73604 6.17103 numMergedOcc 0
7 mol 134 unq 2 iso 0 dist 4.9155 7.85849 5.71679 9.30817 6.54501 7.69991 13.386 8.6355 8.73604 10.1448 numMergedOcc 0
8 mol 134 unq 3 iso 0 dist 4.9155 7.85849 5.71679 10.879 6.49416 6.23142 13.386 8.6355 8.73604 5.41704 numMergedOcc 0
9 mol 134 unq 4 iso 0 dist 9.42271 6.08299 5.71679 6.16353 6.54501 7.69991 11.8215 8.6355 8.73604 10.1448 numMergedOcc 0
10 mol 134 unq 5 iso 0 dist 9.42271 6.08299 5.71679 7.07625 6.49416 6.23142 11.8215 8.6355 8.73604 5.41704 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 7.70631 9.3055 7.16732 12.7195 8.56633 15.5383 14.5382 8.99696 12.0896 9.82139 numMergedOcc 0
12 mol 197 unq 1 iso 0 dist 7.70631 9.3055 7.16732 12.7195 8.56633 15.5383 12.215 7.85058 13.8231 8.72637 numMergedOcc 0
13 mol 197 unq 2 iso 0 dist 7.70631 9.3055 7.16732 12.7195 8.56633 15.5383 16.4731 9.96638 16.1365 5.69148 numMergedOcc 0
14 mol 209 unq 0 iso 0 dist 5.92907 9.17634 10.6456 5.35615 7.56373 13.9599 10.2593 7.95911 15.999 7.19056 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 6.45574 4.46919 7.60081 6.70342 5.4638 9.55668 5.61388 8.21247 7.95766 4.65302 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 8.49415 7.87337 13.6299 4.05162 8.4218 9.58094 9.3596 6.34034 13.9273 6.43013 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 7.23956 6.71956 7.70529 15.6875 9.7748 16.795 12.9898 9.41725 14.3284 6.58374 numMergedOcc 0
18 mol 278 unq 0 iso 0 dist 9.91518 6.9592 14.3412 12.8387 8.44326 18.2538 7.70648 6.35287 12.2665 6.07447 numMergedOcc 0
