0 mol 54 unq 0 iso 0 dist 5.97635 6.76462 6.83299 8.98505 5.02241 5.06052 4.38047 4.29856 6.14538 6.30987 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 4.88613 5.40367 6.35756 9.80755 8.89374 6.47744 5.84625 5.49591 8.80614 9.11258 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 6.65344 13.1729 7.71095 10.4897 6.71911 5.33688 16.2055 9.64444 6.73347 9.2902 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 8.99491 4.96726 9.67592 6.84612 8.68586 5.3948 6.23138 6.21578 9.97159 9.32552 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 6.18305 4.69583 6.19304 4.31731 4.65521 7.41074 9.54477 6.56633 9.24757 7.10439 numMergedOcc 0
5 mol 126 unq 0 iso 0 dist 8.32241 4.84035 6.06638 4.56139 7.75534 7.01257 8.97111 6.0268 6.30546 7.36017 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 5.86531 6.26797 7.11802 5.80615 7.92688 4.68409 6.42904 5.92062 9.22661 6.51868 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 5.86531 6.26797 7.11802 5.80615 7.92688 4.68409 10.0298 6.61891 7.56378 7.34698 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 9.92932 10.5108 8.94367 6.27009 8.79571 5.41704 12.1527 4.57832 6.23142 8.73604 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 9.92932 6.20443 9.86662 6.27009 8.79571 6.17103 12.1527 4.57832 9.94764 8.73604 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 9.60411 10.5108 6.37586 6.27009 5.42582 5.41704 12.1527 5.29786 6.23142 8.73604 numMergedOcc 0
11 mol 134 unq 3 iso 0 dist 9.60411 6.20443 9.71307 6.27009 5.42582 6.17103 12.1527 5.29786 9.94764 8.73604 numMergedOcc 0
12 mol 134 unq 4 iso 0 dist 9.55556 11.9294 8.94367 10.2625 8.79571 5.41704 11.9876 4.57832 6.23142 8.73604 numMergedOcc 0
13 mol 134 unq 5 iso 0 dist 9.55556 6.36794 9.86662 10.2625 8.79571 6.17103 11.9876 4.57832 9.94764 8.73604 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 9.84952 12.9554 7.63312 11.14 7.98142 9.60512 13.401 5.63555 5.9176 5.97685 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 9.84952 12.9554 7.63312 10.9006 7.37327 13.3389 13.401 5.63555 5.9176 8.9289 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 8.48065 5.23741 5.4638 5.52698 8.21247 4.65302 10.8785 7.60081 9.55668 7.95766 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 8.43858 8.55312 6.24356 12.5468 9.0012 5.12409 13.7665 7.52936 5.93616 5.91213 numMergedOcc 0
18 mol 264 unq 1 iso 0 dist 8.43858 8.55312 6.24356 15.8008 9.5784 9.67998 13.7665 7.52936 5.93616 7.34094 numMergedOcc 0
