0 mol 9 unq 0 iso 0 dist 9.8978 11.3797 9.62394 6.67398 9.57198 5.60154 12.8762 9.5997 8.57077 8.47421 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.26276 11.7623 9.62394 9.03359 9.57198 5.60154 13.0231 9.5997 8.57077 8.47421 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 9.52695 5.8961 5.96346 6.65725 8.73067 8.05213 14.3284 10.9183 14.7815 9.53002 numMergedOcc 0
3 mol 27 unq 0 iso 0 dist 5.66743 9.49066 9.52474 11.6846 7.60283 7.50515 19.7162 14.3929 17.0333 9.77484 numMergedOcc 0
4 mol 27 unq 1 iso 0 dist 7.42669 4.91484 9.52474 8.05284 7.60283 7.50515 16.4314 14.3929 17.0333 9.77484 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 4.38047 6.76462 6.14538 8.98505 6.30987 5.06052 5.97635 4.29856 6.83299 5.02241 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 5.84625 5.40367 8.80614 10.3974 7.6481 13.9007 15.1543 9.62267 18.1669 8.81638 numMergedOcc 0
7 mol 58 unq 1 iso 0 dist 5.84625 5.40367 8.80614 9.80755 9.11258 6.47744 9.01612 10.2049 6.86465 8.63333 numMergedOcc 0
8 mol 58 unq 2 iso 0 dist 5.84625 5.40367 8.80614 9.80755 9.11258 6.47744 4.88613 5.49591 6.35756 8.89374 numMergedOcc 0
9 mol 58 unq 3 iso 0 dist 5.84625 5.40367 8.80614 9.80755 9.11258 6.47744 10.3132 5.85698 10.3224 6.46761 numMergedOcc 0
10 mol 58 unq 4 iso 0 dist 5.84625 5.40367 8.80614 9.80755 9.11258 6.47744 16.5848 12.2123 15.4557 9.73139 numMergedOcc 0
11 mol 64 unq 0 iso 0 dist 6.23138 4.96726 9.97159 6.84612 9.32552 5.3948 8.99491 6.21578 9.67592 8.68586 numMergedOcc 0
12 mol 64 unq 1 iso 0 dist 6.23138 4.96726 9.97159 6.84612 9.32552 5.3948 13.8335 11.4485 14.5656 9.54144 numMergedOcc 0
13 mol 92 unq 0 iso 0 dist 9.18898 4.52119 6.95572 10.4617 5.39745 6.99832 11.8917 9.50382 7.4729 5.81965 numMergedOcc 0
14 mol 92 unq 1 iso 0 dist 9.18898 4.52119 6.95572 10.4617 5.39745 6.99832 16.1657 11.3858 11.862 7.06013 numMergedOcc 0
15 mol 92 unq 2 iso 0 dist 9.18898 4.52119 6.95572 10.4617 5.39745 6.99832 9.79361 7.56363 6.82344 9.70512 numMergedOcc 0
16 mol 126 unq 0 iso 0 dist 8.97111 4.84035 6.30546 4.56139 7.36017 7.01257 8.32241 6.0268 6.06638 7.75534 numMergedOcc 0
17 mol 126 unq 1 iso 0 dist 8.97111 4.84035 6.30546 4.56139 7.36017 7.01257 11.9998 10.1326 12.1593 9.06011 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 6.42904 6.26797 9.22661 5.80615 6.51868 4.68409 5.86531 5.92062 7.11802 7.92688 numMergedOcc 0
19 mol 133 unq 1 iso 0 dist 7.31633 5.36939 7.56378 6.2062 7.34698 4.68409 10.8427 6.61891 7.11802 7.92688 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 5.66363 9.47799 8.90963 7.58472 5.95304 8.25067 14.039 9.34211 9.15386 9.6668 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 5.97968 9.09989 8.90963 4.24915 5.95304 8.25067 12.9138 9.34211 9.15386 9.6668 numMergedOcc 0
22 mol 181 unq 2 iso 0 dist 8.50382 12.4243 8.90963 4.20499 5.95304 8.25067 12.2786 9.34211 9.15386 9.6668 numMergedOcc 0
23 mol 181 unq 3 iso 0 dist 8.63119 4.98009 8.90963 5.70246 5.95304 8.25067 11.7479 9.34211 9.15386 9.6668 numMergedOcc 0
24 mol 181 unq 4 iso 0 dist 6.95568 4.11061 6.59025 6.28043 6.32777 7.07409 11.4517 5.77299 10.7062 7.13543 numMergedOcc 0
25 mol 181 unq 5 iso 0 dist 9.07527 9.32503 5.9176 6.24616 5.97685 9.60512 12.06 5.63555 7.63312 7.98142 numMergedOcc 0
26 mol 181 unq 6 iso 0 dist 9.07527 9.32503 5.9176 12.5567 8.9289 13.3389 12.06 5.63555 7.63312 7.37327 numMergedOcc 0
27 mol 188 unq 0 iso 0 dist 9.37017 4.04545 8.10214 14.7966 9.33696 12.0548 16.8862 10.5721 13.353 6.90541 numMergedOcc 0
