RDKit 3D 47 50 0 0 0 0 0 0 0 0999 V2000 -0.1462 2.4936 2.0987 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2048 3.1335 0.9364 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2282 2.2712 -0.3052 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6779 3.2057 -1.4374 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1084 1.7299 -0.5834 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2687 0.2493 -0.4882 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0842 -0.4745 -0.6887 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1696 -0.0400 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3138 1.3046 -0.1045 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5467 1.7893 0.2933 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 3.0109 0.4732 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5509 0.9698 0.4853 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4738 -0.3272 0.3227 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5634 -1.1446 0.5388 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4069 -2.4999 0.3475 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1986 -3.0248 -0.0479 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0961 -2.2096 -0.2678 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7869 -2.7687 -0.6964 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2487 -0.8656 -0.0787 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2722 -0.2594 -1.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0902 -0.7142 -0.3096 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4488 -0.0318 -0.2994 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2555 -2.1900 -0.1659 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1133 -0.1424 0.6941 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5670 -1.0266 1.5889 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1158 1.4175 2.1864 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1262 3.0541 3.0358 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 4.2025 0.9033 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3642 4.2344 -1.1968 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7487 3.1051 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0759 2.9157 -2.3433 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8595 2.2415 0.0761 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4218 2.0239 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5331 -0.7354 0.8547 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2882 -3.1124 0.5275 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0876 -4.0983 -0.1958 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -2.4608 -1.7338 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0065 -2.6768 0.0453 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9504 -3.8843 -0.8012 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0642 -0.5764 -1.0707 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3956 1.0147 -0.6361 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9098 -0.1852 0.6759 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3662 -2.7857 -0.3753 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7092 -2.3970 0.8378 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0501 -2.5238 -0.8959 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5526 0.7422 1.2347 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8141 -1.9541 1.4485 H 0 0 0 0 0 0 0 0 0 0 0 0 18 17 1 0 17 19 2 0 19 13 1 0 13 12 1 0 12 10 1 0 10 11 2 0 10 9 1 0 9 8 2 0 8 7 1 0 6 7 1 1 6 5 1 0 5 3 1 0 3 4 1 0 3 2 1 1 2 1 2 3 6 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 21 24 1 0 24 25 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 8 19 1 0 24 6 1 0 3 9 1 0 18 37 1 0 18 38 1 0 18 39 1 0 5 32 1 0 5 33 1 0 4 29 1 0 4 30 1 0 4 31 1 0 2 28 1 0 1 26 1 0 1 27 1 0 22 40 1 0 22 41 1 0 22 42 1 0 23 43 1 0 23 44 1 0 23 45 1 0 24 46 1 1 25 47 1 0 14 34 1 0 15 35 1 0 16 36 1 0 M END