RDKit 3D 73 76 0 0 0 0 0 0 0 0999 V2000 -4.7634 2.5208 3.6533 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2272 1.9525 2.4763 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2388 2.6202 1.7369 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8352 3.7422 2.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7415 1.9632 0.5368 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2191 0.7915 0.1875 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5149 -0.1920 -0.6994 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1236 -0.4548 -0.3125 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1157 -0.4180 -1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8228 0.7312 -1.4461 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0001 0.4323 -0.6916 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2577 0.2640 -1.2419 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3429 0.3868 -2.4851 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -0.0365 -0.4835 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4615 -0.1869 0.8318 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6721 -0.4888 1.5589 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9588 -0.6716 1.0974 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7868 -0.9362 2.1129 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2127 -1.1939 2.0945 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0371 -0.9232 3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7607 -0.6537 2.8868 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2418 2.0531 -1.0812 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7693 3.1889 -1.9313 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 2.4313 0.3525 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6047 3.1856 0.6537 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6946 2.7256 -0.2065 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2642 3.8842 -0.7924 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1225 2.0268 -1.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9693 -1.7407 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4424 -2.1475 0.8748 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9408 -2.5697 0.6663 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3222 -2.3345 0.2922 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0321 -1.8563 1.3852 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3891 -1.4181 -0.8736 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2088 -2.1053 -2.1904 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5629 -1.1268 -3.2898 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1928 -3.2423 -2.2605 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5285 1.8933 4.5509 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8724 2.5426 3.5212 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3557 3.5403 3.8132 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1890 0.4865 0.5512 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5338 0.2664 -1.7422 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8676 0.3207 0.4901 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7065 -0.3872 -2.3801 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3966 -1.3939 -1.4418 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2127 0.7775 -2.5115 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3834 -0.1508 -1.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5405 -0.0799 1.3805 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2316 -0.6051 0.0579 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4523 -2.2582 1.9251 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6982 -0.8943 3.0406 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7022 -0.6180 1.2847 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3477 -1.0946 4.2419 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 3.0203 -2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2689 4.1205 -1.5696 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8459 3.3520 -1.8155 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2982 2.1525 0.9633 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5917 3.9813 1.4163 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0743 3.5464 -1.2703 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9863 -1.2523 1.2181 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3203 -2.7997 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9471 -2.6734 0.0422 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6629 -3.4994 1.2115 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7935 -3.2941 -0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4545 -2.5922 1.8973 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4584 -1.0330 -0.8949 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1763 -2.4817 -2.3084 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1287 -0.2377 -2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6402 -0.7526 -3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2492 -1.5772 -4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7606 -4.1771 -1.8376 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1669 -2.9723 -1.7878 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4458 -3.3789 -3.3527 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 18 20 1 0 20 21 2 0 10 22 1 0 22 23 1 6 22 28 1 0 28 26 1 0 26 27 1 6 26 25 1 0 25 24 2 0 8 29 1 0 29 30 1 0 29 31 2 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 26 5 1 0 34 7 1 0 21 16 1 0 24 22 1 0 1 38 1 0 1 39 1 0 1 40 1 0 6 41 1 0 7 42 1 6 8 43 1 1 9 44 1 0 9 45 1 0 10 46 1 6 14 47 1 0 15 48 1 0 17 49 1 0 19 50 1 0 19 51 1 0 19 52 1 0 20 53 1 0 23 54 1 0 23 55 1 0 23 56 1 0 27 59 1 0 25 58 1 0 24 57 1 0 30 60 1 0 30 61 1 0 30 62 1 0 31 63 1 0 32 64 1 6 33 65 1 0 34 66 1 6 35 67 1 0 36 68 1 0 36 69 1 0 36 70 1 0 37 71 1 0 37 72 1 0 37 73 1 0 M END