RDKit 3D 86 89 0 0 0 0 0 0 0 0999 V2000 0.4258 -1.7414 2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5789 -0.6489 1.6366 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6603 0.3188 1.9537 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0337 1.4280 2.5463 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4308 0.7502 0.7553 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4493 -0.1480 0.5143 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7279 0.3957 0.6235 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3463 0.3420 -0.6084 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7086 0.3196 -0.6102 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2848 0.7247 -1.9485 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6777 0.6612 -1.8187 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3652 1.0710 0.5262 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7305 0.8486 0.5756 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7778 0.6736 1.8633 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7016 -0.0106 2.6274 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5961 -0.2865 1.6271 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0340 -0.5166 2.8541 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5814 1.0276 -0.4503 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5342 -0.0199 -0.7100 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2217 -1.1887 -1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3938 0.5654 -1.7858 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8333 0.1108 -1.5302 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8752 -1.3081 -1.0939 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2121 -1.9023 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7571 -1.8479 -2.5372 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9239 -3.4553 -0.9444 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -1.5277 -0.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7539 -0.3858 -0.1281 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.1364 -0.6564 -0.4493 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8124 0.5075 -0.6742 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.4911 1.1909 -1.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7706 0.4021 -3.0824 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7718 1.5143 0.4309 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.3665 0.9492 1.5557 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3231 1.8007 0.7742 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.2338 2.5966 1.9164 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7266 0.4273 1.1339 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4532 0.5691 1.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2116 -1.5130 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2945 -0.3335 0.4852 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1259 -1.8852 3.2211 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3235 -2.4969 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3246 -0.1611 2.6967 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3836 2.2391 2.1394 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9248 1.7303 0.9999 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6619 1.4815 0.8931 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0202 -0.7588 -0.4701 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9358 1.6900 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0149 -0.1038 -2.6568 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0737 1.0583 -2.6199 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1604 2.1511 0.3877 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8586 -0.1363 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3587 1.5421 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0959 0.5417 3.3322 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0125 -1.2567 1.2501 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7983 0.2951 3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2479 1.0622 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0974 2.0116 -0.3495 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9986 -2.1668 -0.9282 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3482 -1.0984 -1.3003 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0307 -1.2611 -2.4592 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3923 1.6615 -1.6545 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0449 0.3412 -2.8026 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2862 0.7977 -0.7908 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 0.2202 -2.4811 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1947 -1.8814 -1.8548 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4905 -2.6678 -2.7069 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1201 -0.8563 -2.8051 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -2.0763 -3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3526 -3.6080 -0.0191 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8774 -4.0038 -1.0155 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2904 -3.7721 -1.7919 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4786 0.2737 -0.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9029 0.2127 -0.7697 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5089 1.6551 -2.0359 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2237 2.0520 -2.0453 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0787 0.6184 -3.7788 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2863 2.4231 0.0847 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5438 -0.0188 1.4487 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7913 2.2876 -0.0413 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5272 2.1282 2.7206 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4402 0.0368 1.9004 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1044 1.4523 1.3692 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9076 -1.5790 1.1001 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -2.4612 0.2516 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8761 0.5818 0.7285 H 0 0 0 0 0 0 0 0 0 0 0 0 25 24 1 0 24 26 1 0 24 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 30 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 24 23 1 0 23 22 1 0 22 21 1 0 21 19 1 0 19 20 1 6 19 18 1 0 18 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 9 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 5 3 1 0 3 4 1 0 3 2 1 0 2 1 2 3 2 40 1 0 40 39 1 0 37 28 1 0 39 23 1 0 40 19 1 0 16 7 1 0 25 67 1 0 25 68 1 0 25 69 1 0 26 70 1 0 26 71 1 0 26 72 1 0 28 73 1 6 30 74 1 6 31 75 1 0 31 76 1 0 32 77 1 0 33 78 1 6 34 79 1 0 35 80 1 6 36 81 1 0 37 82 1 1 38 83 1 0 23 66 1 6 22 64 1 0 22 65 1 0 21 62 1 0 21 63 1 0 20 59 1 0 20 60 1 0 20 61 1 0 18 57 1 0 18 58 1 0 5 45 1 1 7 46 1 1 9 47 1 1 10 48 1 0 10 49 1 0 11 50 1 0 12 51 1 6 13 52 1 0 14 53 1 1 15 54 1 0 16 55 1 6 17 56 1 0 3 43 1 1 4 44 1 0 1 41 1 0 1 42 1 0 40 86 1 1 39 84 1 0 39 85 1 0 M END