RDKit 3D 87 90 0 0 0 0 0 0 0 0999 V2000 5.2377 2.9257 2.2088 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 2.2339 3.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0361 1.1562 2.2630 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7290 1.7063 1.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2623 -0.0413 1.9473 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6109 -1.1972 2.3825 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1014 -0.0726 1.1646 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4226 -1.2713 0.8987 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1447 -1.4858 -0.5810 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2789 -1.7897 -1.2853 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1017 -2.5427 -0.7707 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0324 -1.9706 -1.4934 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9539 -1.9771 -2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9139 -2.4706 -3.6966 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7764 -2.4491 -5.0896 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -1.9134 -5.6027 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -1.3999 -4.7558 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4831 -0.8694 -5.3547 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7761 -1.4222 -3.3943 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2388 -0.9543 -2.4791 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -1.0027 -1.2302 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4352 -0.4495 -2.8897 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4574 -0.0190 -2.0099 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9898 -1.1563 -1.2033 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5607 -2.4376 -1.4287 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1072 -3.4637 -0.6695 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 -3.1919 0.2761 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4767 -1.8689 0.4891 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9555 -0.8279 -0.2458 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3396 0.4863 -0.0763 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2669 0.9617 0.8621 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.4901 1.2742 0.2955 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7228 2.5656 -0.0467 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.0939 2.9051 -1.4031 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3758 4.2546 -1.6873 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3932 3.6170 0.9498 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.5554 4.2957 1.3131 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8591 2.9766 2.2127 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4127 3.9386 3.0956 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7373 2.0533 1.7582 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.1999 1.4940 2.9366 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6041 -3.1675 0.3093 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5031 -2.6090 1.5273 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0377 -2.6070 1.9614 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8897 -2.0393 3.2174 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0371 -1.1917 1.5354 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1217 -0.6880 2.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3007 2.7587 1.1335 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2628 4.0285 2.3877 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2283 2.6171 2.6182 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 3.0400 3.3417 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8946 1.8141 3.9496 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9090 0.8448 2.9122 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4661 2.4332 1.3429 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0158 2.0802 0.2641 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2940 0.8138 0.6025 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9018 -2.1654 1.3659 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -0.4881 -0.9375 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4337 -2.7574 -1.3008 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5935 -3.3068 -1.4694 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8303 -2.8987 -3.3185 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5838 -2.8606 -5.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4629 -1.8579 -6.6577 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2858 -0.4646 -5.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2784 0.3895 -2.6254 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0705 0.7948 -1.3744 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8186 -2.7010 -2.2027 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7734 -4.4881 -0.8355 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4835 -3.9753 0.8718 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2217 -1.7345 1.2451 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5244 0.1183 1.5848 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8385 2.6310 -0.2516 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6006 2.2947 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0269 2.6866 -1.3935 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3393 4.3686 -1.8461 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6656 4.3624 0.5649 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1652 3.7533 1.8719 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6927 2.4213 2.6676 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0349 4.0866 3.8676 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9655 2.6504 1.2853 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9668 1.1446 3.4405 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0993 -3.2003 2.3188 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7362 -3.6839 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4366 -2.1586 1.1679 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4619 -1.1714 3.1466 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3861 -0.5883 0.8799 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7538 0.0712 2.8408 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 3 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 46 1 0 46 47 1 0 46 43 1 0 43 44 1 0 44 45 1 0 43 42 1 0 42 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 2 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 33 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 11 9 1 0 9 10 1 0 9 8 1 0 19 13 1 0 29 24 1 0 40 31 1 0 1 48 1 0 1 49 1 0 1 50 1 0 2 51 1 0 2 52 1 0 3 53 1 1 4 54 1 0 4 55 1 0 4 56 1 0 8 57 1 1 46 86 1 6 47 87 1 0 43 82 1 1 44 83 1 0 44 84 1 0 45 85 1 0 11 60 1 6 14 61 1 0 15 62 1 0 16 63 1 0 18 64 1 0 23 65 1 0 23 66 1 0 25 67 1 0 26 68 1 0 27 69 1 0 28 70 1 0 31 71 1 1 33 72 1 6 34 73 1 0 34 74 1 0 35 75 1 0 36 76 1 6 37 77 1 0 38 78 1 1 39 79 1 0 40 80 1 6 41 81 1 0 9 58 1 6 10 59 1 0 M END