0 mol 26 unq 0 iso 0 dist 7.34549 4.76147 8.34347 6.42206 5.3315 6.88695 9.08976 11.887 9.16962 6.66387 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.09068 6.30129 8.34347 10.1907 5.3315 6.88695 14.8032 11.887 9.16962 6.66387 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.72289 5.93227 8.34347 9.66602 5.3315 6.88695 13.0219 11.887 9.16962 6.66387 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 5.11612 6.86762 5.83991 8.21127 6.75472 5.02717 11.0433 6.09023 8.66155 9.81097 numMergedOcc 0
4 mol 115 unq 1 iso 0 dist 5.22628 6.8104 6.11741 7.99121 6.59772 4.98864 12.7277 10.8292 6.99777 5.46352 numMergedOcc 0
5 mol 115 unq 2 iso 0 dist 5.22628 6.8104 6.11741 7.99121 6.59772 4.98864 11.1013 6.12943 9.14376 10.1017 numMergedOcc 0
6 mol 115 unq 3 iso 0 dist 5.22628 6.8104 6.11741 6.30982 4.86477 7.95871 12.7277 10.8292 6.99777 10.3995 numMergedOcc 0
7 mol 115 unq 4 iso 0 dist 5.22628 6.8104 6.11741 6.30982 4.86477 7.95871 11.1013 6.12943 9.14376 9.81323 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 8.09965 11.3174 9.30299 15.4787 8.60326 9.42513 10.4013 4.77464 9.81878 10.2034 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 9.50454 11.755 7.63312 18.2681 12.9554 9.84952 8.22583 9.60512 7.98142 11.14 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 9.50454 11.755 7.63312 18.2681 12.9554 9.84952 12.8564 13.3389 7.37327 10.9006 numMergedOcc 0
11 mol 181 unq 2 iso 0 dist 6.43406 10.9813 7.81386 5.08796 4.3158 9.84952 15.0054 9.53462 7.98142 11.14 numMergedOcc 0
12 mol 181 unq 3 iso 0 dist 6.43406 10.9813 7.81386 5.08796 4.3158 9.84952 14.1437 11.1462 7.37327 10.9006 numMergedOcc 0
13 mol 181 unq 4 iso 0 dist 8.80581 10.209 7.63312 18.2493 12.9554 9.84952 16.0943 9.60512 7.98142 11.14 numMergedOcc 0
14 mol 181 unq 5 iso 0 dist 8.80581 10.209 7.63312 18.2493 12.9554 9.84952 17.06 13.3389 7.37327 10.9006 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 6.04106 12.9245 7.26832 16.5797 10.7091 5.96555 9.70674 6.23291 9.19704 12.5517 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 9.61379 9.57016 8.95269 16.4561 9.98893 8.39002 11.9527 7.98696 6.87664 7.90095 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 7.17032 9.25445 9.45496 13.1219 12.0816 7.86368 15.1563 15.9563 9.5707 16.9465 numMergedOcc 0
18 mol 234 unq 1 iso 0 dist 7.17032 9.25445 9.45496 13.1219 12.0816 7.86368 11.5443 11.216 7.85175 15.442 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 8.84872 4.28841 5.4638 10.014 5.23741 8.48065 11.4738 4.65302 8.21247 5.52698 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 8.39522 4.88998 6.57393 12.0437 10.3859 9.13537 6.59305 6.20606 5.38637 6.16476 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 5.99187 5.74685 6.22714 15.0135 12.2428 9.66555 9.63117 5.17471 7.49471 8.92175 numMergedOcc 0
22 mol 238 unq 2 iso 0 dist 5.99187 5.74685 6.22714 13.0521 8.66185 8.67205 9.63117 5.17471 7.49471 5.94371 numMergedOcc 0
23 mol 265 unq 0 iso 0 dist 6.78702 4.75685 8.4218 8.09021 5.75478 9.772 7.74463 6.43013 6.34034 5.55314 numMergedOcc 0
24 mol 265 unq 1 iso 0 dist 8.59825 11.5105 8.4218 6.98451 5.75478 9.772 11.0134 6.43013 6.34034 5.55314 numMergedOcc 0
