9DN Converted by convert_cif2sdf.py 2024/03/29 11:09:15 44 45 0 0 0 0 0 0 0 0999 V2000 -3.0329 -0.4344 -0.8157 N 0 0 0 0 0 -3.4838 -0.3991 0.5784 C 0 0 0 0 0 -2.4365 -1.0277 1.4613 C 0 0 0 0 0 -1.4185 -1.4604 0.9761 O 0 0 0 0 0 -4.7947 -1.1756 0.7095 C 0 0 0 0 0 -5.8746 -0.4773 -0.0763 C 0 0 0 0 0 -5.6201 0.5421 -0.6827 O 0 0 0 0 0 -7.1225 -0.9853 -0.1065 N 0 0 0 0 0 -2.6354 -1.1056 2.7857 O 0 0 0 0 0 -2.3124 0.8975 -1.4868 S 0 0 0 0 0 -3.1310 2.0085 -1.1490 O 0 0 0 0 0 -1.9921 0.5475 -2.8259 O 0 0 0 0 0 3.7153 -0.3793 0.4432 N 0 0 0 0 0 -0.7792 1.1367 -0.6539 C 0 0 0 0 0 -0.5805 2.2473 0.1073 C 0 0 0 0 0 0.6263 2.4530 0.7738 C 0 0 0 0 0 1.6406 1.5495 0.6820 C 0 0 0 0 0 1.4722 0.3924 -0.0949 C 0 0 0 0 0 0.2432 0.1794 -0.7669 C 0 0 0 0 0 0.0707 -0.9819 -1.5396 C 0 0 0 0 0 1.0777 -1.8937 -1.6316 C 0 0 0 0 0 2.2865 -1.6979 -0.9708 C 0 0 0 0 0 2.5007 -0.5665 -0.2134 C 0 0 0 0 0 3.9790 -1.4756 1.3848 C 0 0 0 0 0 4.8174 -0.2347 -0.5174 C 0 0 0 0 0 -3.1563 -1.2383 -1.3446 H 0 0 0 0 0 -1.9353 -1.5170 3.3121 H 0 0 0 0 0 4.0166 -2.4204 0.8421 H 0 0 0 0 0 4.9325 -1.3051 1.8836 H 0 0 0 0 0 3.1823 -1.5164 2.1275 H 0 0 0 0 0 4.6297 0.6269 -1.1580 H 0 0 0 0 0 5.7534 -0.0907 0.0220 H 0 0 0 0 0 4.8856 -1.1348 -1.1300 H 0 0 0 0 0 -1.3686 2.9792 0.1972 H 0 0 0 0 0 0.7583 3.3428 1.3724 H 0 0 0 0 0 2.5707 1.7226 1.2022 H 0 0 0 0 0 -0.8604 -1.1522 -2.0599 H 0 0 0 0 0 0.9357 -2.7833 -2.2276 H 0 0 0 0 0 3.0694 -2.4368 -1.0609 H 0 0 0 0 0 -3.6422 0.6357 0.8824 H 0 0 0 0 0 -4.6600 -2.1862 0.3223 H 0 0 0 0 0 -5.0850 -1.2251 1.7590 H 0 0 0 0 0 -7.3265 -1.8004 0.3785 H 0 0 0 0 0 -7.8172 -0.5352 -0.6121 H 0 0 0 0 0 10 11 2 0 0 0 10 12 2 0 0 0 10 14 1 0 0 0 10 1 1 0 0 0 9 3 1 0 0 0 13 23 1 0 0 0 13 24 1 0 0 0 13 25 1 0 0 0 14 15 1 0 0 0 14 19 2 0 0 0 15 16 2 0 0 0 16 17 1 0 0 0 17 18 2 0 0 0 18 19 1 0 0 0 18 23 1 0 0 0 19 20 1 0 0 0 20 21 2 0 0 0 21 22 1 0 0 0 22 23 2 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 2 5 1 0 0 0 3 4 2 0 0 0 5 6 1 0 0 0 6 7 2 0 0 0 6 8 1 0 0 0 1 26 1 0 0 0 9 27 1 0 0 0 24 28 1 0 0 0 24 29 1 0 0 0 24 30 1 0 0 0 25 31 1 0 0 0 25 32 1 0 0 0 25 33 1 0 0 0 15 34 1 0 0 0 16 35 1 0 0 0 17 36 1 0 0 0 20 37 1 0 0 0 21 38 1 0 0 0 22 39 1 0 0 0 2 40 1 0 0 0 5 41 1 0 0 0 5 42 1 0 0 0 8 43 1 0 0 0 8 44 1 0 0 0 M END $$$$