0 mol 26 unq 0 iso 0 dist 6.88695 5.3315 8.34347 6.66387 9.16962 11.887 11.2671 12.5438 7.98005 16.138 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 6.88695 5.3315 8.34347 6.66387 9.16962 11.887 7.89667 8.39015 8.31381 10.343 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.38387 11.0096 8.80331 6.35048 9.83618 10.4442 14.8727 9.86609 7.39848 16.4643 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.2377 4.99283 5.93252 12.6436 5.64598 9.77992 10.0651 3.85805 9.10566 7.78587 numMergedOcc 0
4 mol 75 unq 0 iso 0 dist 6.95595 12.7957 7.79912 8.91765 5.15851 10.0425 11.2061 4.74027 9.16597 7.30467 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 6.4551 8.78063 6.97941 13.2281 9.49449 6.06861 6.46582 3.69293 7.61521 8.90522 numMergedOcc 0
6 mol 127 unq 0 iso 0 dist 9.42513 8.60326 9.30299 10.2034 9.81878 4.77464 13.884 12.7606 5.39356 7.79077 numMergedOcc 0
7 mol 127 unq 1 iso 0 dist 9.42513 8.60326 9.30299 10.2034 9.81878 4.77464 12.5636 12.6193 9.92746 14.5349 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 8.07256 10.4039 8.56324 6.51591 9.13561 5.99333 14.986 9.73449 7.55934 12.999 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 5.96555 10.7091 7.26832 12.5517 9.19704 6.23291 16.1999 13.3822 7.13783 12.4189 numMergedOcc 0
10 mol 235 unq 0 iso 0 dist 8.48065 5.23741 5.4638 5.52698 8.21247 4.65302 8.1174 4.75609 8.08965 9.11149 numMergedOcc 0
11 mol 259 unq 0 iso 0 dist 6.42725 8.70769 5.30224 7.53102 6.77938 4.99891 9.9749 5.96249 9.18798 8.22608 numMergedOcc 0
12 mol 259 unq 1 iso 0 dist 6.42725 8.70769 5.30224 7.53102 6.77938 4.99891 6.69951 5.97386 8.25897 5.23503 numMergedOcc 0
13 mol 259 unq 2 iso 0 dist 6.42725 8.70769 5.30224 6.58569 7.76676 5.32839 9.9749 5.96249 9.18798 12.4194 numMergedOcc 0
14 mol 259 unq 3 iso 0 dist 6.42725 8.70769 5.30224 6.58569 7.76676 5.32839 6.69951 5.97386 8.25897 9.61028 numMergedOcc 0
15 mol 265 unq 0 iso 0 dist 9.772 5.75478 8.4218 5.55314 6.34034 6.43013 5.8898 7.71667 5.7944 8.03604 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 9.29635 10.8075 9.7748 13.8592 9.41725 6.58374 5.11998 7.75371 5.69112 9.62597 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 9.29635 10.8075 9.7748 13.8592 9.41725 6.58374 5.79925 11.3546 7.2091 11.5874 numMergedOcc 0
