052 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 70 75 0 0 0 0 0 0 0 0999 V2000 0.9596 1.7785 0.0140 C 0 0 0 0 0 2.9578 -4.2344 -0.7163 C 0 0 0 0 0 2.0577 -4.2029 -1.7651 C 0 0 0 0 0 0.4200 -3.2033 -0.3279 C 0 0 0 0 0 1.3243 -3.2398 0.7247 C 0 0 0 0 0 2.5902 -3.7553 0.5280 C 0 0 0 0 0 4.4979 2.2161 -1.1241 C 0 0 0 0 0 2.4243 1.6185 -0.0904 C 0 0 0 0 0 3.0908 0.7188 0.7484 C 0 0 0 0 0 4.4443 0.5733 0.6562 C 0 0 0 0 0 5.2743 3.0212 -2.1344 C 0 0 0 0 0 5.1653 1.3213 -0.2822 C 0 0 0 0 0 6.6280 1.1642 -0.3826 C 0 0 0 0 0 9.3559 -1.0304 0.9995 C 0 0 0 0 0 9.5487 0.3158 1.7011 C 0 0 0 0 0 -8.4251 1.1814 0.8208 C 0 0 0 0 0 -9.6470 0.2623 0.8960 C 0 0 0 0 0 -9.8087 -0.4099 -0.3556 O 0 0 0 0 0 -8.6759 -1.1940 -0.7387 C 0 0 0 0 0 -7.4439 -0.2903 -0.8304 C 0 0 0 0 0 -7.2420 0.3867 0.4581 N 0 0 0 0 0 -6.0342 1.2231 0.4308 C 0 0 0 0 0 -4.7995 0.3300 0.2991 C 0 0 0 0 0 -3.5946 1.1635 0.2707 N 0 0 0 0 0 0.1137 -0.5788 -0.0709 N 0 0 0 0 0 -2.3528 0.5772 0.1563 C 0 0 0 0 0 -2.2339 -0.7819 0.0683 C 0 0 0 0 0 -0.9594 -1.3515 -0.0479 C 0 0 0 0 0 0.2597 2.9897 0.1254 C 0 0 0 0 0 0.0064 0.7496 0.0152 C 0 0 0 0 0 -1.2197 1.3482 0.1288 N 0 0 0 0 0 -1.0211 2.7320 0.1950 N 0 0 0 0 0 -0.8258 -2.6962 -0.1366 O 0 0 0 0 0 0.7898 -3.6883 -1.5734 C 0 0 0 0 0 3.1443 2.3654 -1.0268 C 0 0 0 0 0 7.2409 1.7305 -1.2671 O 0 0 0 0 0 7.2853 0.3930 0.5058 N 0 0 0 0 0 8.7390 0.2367 0.4055 C 0 0 0 0 0 3.9488 -4.6364 -0.8678 H 0 0 0 0 0 2.3453 -4.5800 -2.7349 H 0 0 0 0 0 1.0397 -2.8626 1.6955 H 0 0 0 0 0 3.2946 -3.7852 1.3462 H 0 0 0 0 0 2.5340 0.1419 1.4721 H 0 0 0 0 0 4.9584 -0.1209 1.3036 H 0 0 0 0 0 5.4296 2.4245 -3.0333 H 0 0 0 0 0 4.7149 3.9219 -2.3888 H 0 0 0 0 0 6.2390 3.3003 -1.7129 H 0 0 0 0 0 10.2179 -1.4590 0.4872 H 0 0 0 0 0 8.6810 -1.7486 1.4652 H 0 0 0 0 0 8.9998 0.4829 2.6282 H 0 0 0 0 0 10.5367 0.7725 1.6501 H 0 0 0 0 0 -8.5924 1.9493 0.0647 H 0 0 0 0 0 -8.2635 1.6542 1.7899 H 0 0 0 0 0 -9.5011 -0.4720 1.6882 H 0 0 0 0 0 -10.5362 0.8557 1.1090 H 0 0 0 0 0 -8.5025 -1.9715 0.0061 H 0 0 0 0 0 -8.8628 -1.6543 -1.7092 H 0 0 0 0 0 -6.5666 -0.8923 -1.0665 H 0 0 0 0 0 -7.5959 0.4536 -1.6122 H 0 0 0 0 0 -6.0834 1.9039 -0.4186 H 0 0 0 0 0 -5.9699 1.7984 1.3544 H 0 0 0 0 0 -4.7503 -0.3507 1.1485 H 0 0 0 0 0 -4.8638 -0.2452 -0.6245 H 0 0 0 0 0 -3.6710 2.1288 0.3326 H 0 0 0 0 0 -3.1128 -1.4087 0.0879 H 0 0 0 0 0 0.7048 3.9731 0.1499 H 0 0 0 0 0 0.0883 -3.6603 -2.3947 H 0 0 0 0 0 2.6292 3.0596 -1.6743 H 0 0 0 0 0 6.7970 -0.0589 1.2104 H 0 0 0 0 0 9.1939 0.6424 -0.4982 H 0 0 0 0 0 19 18 1 0 0 0 19 20 1 0 0 0 18 17 1 0 0 0 17 16 1 0 0 0 20 21 1 0 0 0 16 21 1 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 23 24 1 0 0 0 24 26 1 0 0 0 26 27 2 0 0 0 26 31 1 0 0 0 27 28 1 0 0 0 32 31 1 0 0 0 32 29 2 0 0 0 31 30 1 0 0 0 28 33 1 0 0 0 28 25 2 0 0 0 33 4 1 0 0 0 29 1 1 0 0 0 30 25 1 0 0 0 30 1 2 0 0 0 1 8 1 0 0 0 4 5 2 0 0 0 4 34 1 0 0 0 5 6 1 0 0 0 8 35 2 0 0 0 8 9 1 0 0 0 34 3 2 0 0 0 6 2 2 0 0 0 35 7 1 0 0 0 9 10 2 0 0 0 3 2 1 0 0 0 7 11 1 0 0 0 7 12 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 36 13 2 0 0 0 13 37 1 0 0 0 37 38 1 0 0 0 38 14 1 0 0 0 38 15 1 0 0 0 14 15 1 0 0 0 2 39 1 0 0 0 3 40 1 0 0 0 5 41 1 0 0 0 6 42 1 0 0 0 9 43 1 0 0 0 10 44 1 0 0 0 11 45 1 0 0 0 11 46 1 0 0 0 11 47 1 0 0 0 14 48 1 0 0 0 14 49 1 0 0 0 15 50 1 0 0 0 15 51 1 0 0 0 16 52 1 0 0 0 16 53 1 0 0 0 17 54 1 0 0 0 17 55 1 0 0 0 19 56 1 0 0 0 19 57 1 0 0 0 20 58 1 0 0 0 20 59 1 0 0 0 22 60 1 0 0 0 22 61 1 0 0 0 23 62 1 0 0 0 23 63 1 0 0 0 24 64 1 0 0 0 27 65 1 0 0 0 29 66 1 0 0 0 34 67 1 0 0 0 35 68 1 0 0 0 37 69 1 0 0 0 38 70 1 0 0 0 M END $$$$