CTI Converted by convert_cif2sdf.py 2024/03/29 11:09:15 44 48 0 0 0 0 0 0 0 0999 V2000 -3.6137 0.8427 0.1793 C 0 0 0 0 0 -2.6945 -0.1671 -0.1058 C 0 0 0 0 0 -3.1736 -1.5011 -0.1913 C 0 0 0 0 0 -4.5528 -1.7517 -0.2174 C 0 0 0 0 0 -1.2717 0.0717 -0.3496 C 0 0 0 0 0 -0.4090 -1.0502 -0.2830 C 0 0 0 0 0 -0.9275 -2.3506 -0.1997 C 0 0 0 0 0 -2.2596 -2.5767 -0.1930 C 0 0 0 0 0 -0.7522 1.2459 -0.7103 N 0 3 0 0 0 1.0366 -0.8166 -0.2591 C 0 0 0 0 0 1.4858 0.5205 -0.4061 C 0 0 0 0 0 0.5297 1.5178 -0.6593 C 0 0 0 0 0 -1.5849 2.2893 -1.3163 C 0 0 0 0 0 3.7521 -0.2442 -0.1443 C 0 0 0 0 0 3.2981 -1.5577 -0.0504 C 0 0 0 0 0 1.9626 -1.8452 -0.1022 C 0 0 0 0 0 2.8584 0.7993 -0.3150 C 0 0 0 0 0 3.3097 2.0788 -0.3927 O 0 0 0 0 0 3.4182 2.8046 0.8327 C 0 0 0 0 0 5.0850 0.0143 -0.0683 O 0 0 0 0 0 5.9540 -1.1059 0.1083 C 0 0 0 0 0 -4.9649 0.5751 0.2197 C 0 0 0 0 0 -5.4399 -0.7244 -0.0051 C 0 0 0 0 0 -6.0423 1.3788 0.4471 O 0 0 0 0 0 -7.1496 0.5183 0.7465 C 0 0 0 0 0 -6.8011 -0.6821 0.0400 O 0 0 0 0 0 -3.2892 1.8407 0.4387 H 0 0 0 0 0 -4.9167 -2.7527 -0.4070 H 0 0 0 0 0 -0.2512 -3.1909 -0.1376 H 0 0 0 0 0 -2.6301 -3.5910 -0.1872 H 0 0 0 0 0 0.8488 2.5370 -0.8170 H 0 0 0 0 0 -1.9964 2.9259 -0.5328 H 0 0 0 0 0 -0.9772 2.8915 -1.9911 H 0 0 0 0 0 -2.3986 1.8268 -1.8743 H 0 0 0 0 0 4.0105 -2.3606 0.0658 H 0 0 0 0 0 1.6300 -2.8701 -0.0222 H 0 0 0 0 0 2.4375 2.8679 1.3049 H 0 0 0 0 0 4.1096 2.2895 1.5001 H 0 0 0 0 0 3.7888 3.8090 0.6290 H 0 0 0 0 0 5.7022 -1.6195 1.0363 H 0 0 0 0 0 5.8364 -1.7923 -0.7301 H 0 0 0 0 0 6.9875 -0.7602 0.1531 H 0 0 0 0 0 -7.2208 0.3318 1.8181 H 0 0 0 0 0 -8.0815 0.9375 0.3647 H 0 0 0 0 0 1 2 2 0 0 0 1 22 1 0 0 0 2 3 1 0 0 0 2 5 1 0 0 0 3 4 2 0 0 0 3 8 1 0 0 0 4 23 1 0 0 0 5 6 2 0 0 0 5 9 1 0 0 0 6 7 1 0 0 0 6 10 1 0 0 0 7 8 2 0 0 0 9 12 2 0 0 0 9 13 1 0 0 0 10 11 2 0 0 0 10 16 1 0 0 0 11 12 1 0 0 0 11 17 1 0 0 0 14 15 1 0 0 0 14 17 2 0 0 0 14 20 1 0 0 0 15 16 2 0 0 0 17 18 1 0 0 0 18 19 1 0 0 0 20 21 1 0 0 0 22 23 2 0 0 0 22 24 1 0 0 0 23 26 1 0 0 0 24 25 1 0 0 0 25 26 1 0 0 0 1 27 1 0 0 0 4 28 1 0 0 0 7 29 1 0 0 0 8 30 1 0 0 0 12 31 1 0 0 0 13 32 1 0 0 0 13 33 1 0 0 0 13 34 1 0 0 0 15 35 1 0 0 0 16 36 1 0 0 0 19 37 1 0 0 0 19 38 1 0 0 0 19 39 1 0 0 0 21 40 1 0 0 0 21 41 1 0 0 0 21 42 1 0 0 0 25 43 1 0 0 0 25 44 1 0 0 0 M END $$$$