RDKit 3D 45 48 0 0 0 0 0 0 0 0999 V2000 5.6359 -1.8667 -2.7687 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4373 -1.1485 -2.2261 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2255 0.1953 -2.5332 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0934 0.8605 -2.0488 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1375 0.2183 -1.2409 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3605 -1.1353 -0.9592 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4909 -1.8109 -1.4433 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0123 0.9309 -0.7982 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1379 0.4385 0.2566 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8128 1.6179 0.3603 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2305 2.6365 0.2724 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2294 2.2933 -0.4946 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0897 3.9857 0.8921 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2638 4.0543 2.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4069 5.1597 0.0182 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6855 1.1039 1.4197 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1851 1.7385 2.3274 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8947 -0.2253 1.0401 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8775 -0.6552 0.1745 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7611 -1.7455 -0.3577 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9142 -1.0733 1.5522 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2514 -0.9827 2.9147 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1813 -1.8546 3.4956 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8085 -2.8312 2.7279 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5309 -2.9196 1.3667 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -2.0386 0.7837 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5467 -2.0309 -0.6779 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.6092 -3.1230 -1.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5109 -0.9223 -1.2359 O 0 0 0 0 0 1 0 0 0 0 0 0 5.7649 -2.8457 -2.2953 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5459 -1.2868 -2.5793 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5251 -2.0186 -3.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9327 0.7375 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9532 1.9056 -2.3166 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6659 -1.7139 -0.3607 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6162 -2.8645 -1.2038 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7208 0.2819 1.1808 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4404 1.7496 -0.5372 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2167 6.0850 0.5702 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 5.1353 -0.2749 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2351 5.1438 -0.8672 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -0.2560 3.5684 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4096 -1.7697 4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5323 -3.5040 3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0671 -3.6494 0.7611 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 5 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 2 0 13 15 1 0 10 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 2 0 18 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 27 29 1 0 7 2 1 0 12 8 1 0 19 9 1 0 26 21 1 0 1 30 1 0 1 31 1 0 1 32 1 0 3 33 1 0 4 34 1 0 6 35 1 0 7 36 1 0 9 37 1 1 10 38 1 6 15 39 1 0 15 40 1 0 15 41 1 0 22 42 1 0 23 43 1 0 24 44 1 0 25 45 1 0 M CHG 2 27 1 29 -1 M END