RDKit 3D 50 54 0 0 0 0 0 0 0 0999 V2000 -4.4664 -0.3669 3.1629 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1049 -0.1088 3.0324 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6138 0.5145 1.8836 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4712 0.8639 0.8335 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8453 0.6059 0.9844 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3392 -0.0041 2.1403 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9919 1.5164 -0.4461 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5147 1.6064 -0.6635 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7917 2.6676 -0.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4728 2.4914 -0.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5139 1.3209 -1.4295 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7327 0.7168 -1.4007 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1881 -0.4241 -2.1189 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0024 -1.3725 -1.4864 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4672 -2.4817 -2.1956 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -2.6349 -3.5323 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3149 -1.7029 -4.1739 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8414 -0.5945 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5731 -3.6962 -4.2155 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9531 0.6743 -2.1533 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3295 -0.7143 -1.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8696 -0.2825 0.2823 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1561 0.3099 0.5167 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2503 0.6959 -0.2838 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 1.2634 0.3298 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4253 1.4452 1.7136 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3526 1.0664 2.5264 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2487 0.5068 1.8854 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 0.0738 2.5037 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2748 -0.4078 1.5392 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8436 -1.0168 1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5266 -1.1414 3.0826 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1225 -1.3348 0.8644 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.8371 -0.8572 4.0577 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4008 -0.4056 3.8089 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5396 0.6881 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5401 0.8750 0.1925 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4017 -0.2044 2.2387 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3846 2.5428 -0.4459 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 1.0192 -1.3019 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 -1.3087 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0715 -3.2331 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0597 -1.8433 -5.2189 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2374 0.1385 -3.9966 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1084 -1.3022 -1.5411 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4756 -1.3873 -0.9772 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2197 0.5664 -1.3607 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2204 1.5697 -0.2837 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3062 1.8900 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 1.1967 3.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 4 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 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 2 0 16 19 1 0 11 20 1 0 20 21 1 0 21 22 1 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 28 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 31 33 1 0 6 1 1 0 12 8 1 0 18 13 1 0 30 22 2 0 28 23 1 0 1 34 1 0 2 35 1 0 3 36 1 0 5 37 1 0 6 38 1 0 7 39 1 0 7 40 1 0 14 41 1 0 15 42 1 0 17 43 1 0 18 44 1 0 21 45 1 0 21 46 1 0 24 47 1 0 25 48 1 0 26 49 1 0 27 50 1 0 M CHG 1 33 -1 M END