RDKit 3D 49 51 0 0 0 0 0 0 0 0999 V2000 4.5763 -1.9024 -0.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0191 -0.4452 0.0228 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1358 0.4631 -0.8413 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7076 1.8766 -0.9204 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7309 0.5349 -0.2741 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4376 1.0394 0.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8519 -0.0671 -1.1218 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4829 -0.0422 -0.6939 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1814 1.2065 -1.2444 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4179 2.2256 -1.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6504 1.1691 -1.3465 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3947 2.3182 -1.6295 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8205 3.5391 -1.8646 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7879 2.2648 -1.6778 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4461 1.0570 -1.4415 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8002 0.8652 -1.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6101 2.0069 -1.7066 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6968 -0.0932 -1.1702 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3028 -0.0437 -1.1379 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6603 -1.2234 -0.8764 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2769 -1.2389 -1.2746 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3225 -2.5541 -0.7995 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1248 -3.3145 -1.6652 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7064 -4.5071 -1.2313 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4966 -4.9529 0.0716 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7045 -4.2081 0.9424 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1212 -3.0155 0.5114 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5544 -2.2815 -1.0397 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5809 -2.0274 0.4235 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2723 -2.5213 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0552 -0.3899 -0.3325 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0193 -0.1008 1.0642 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0905 0.0620 -1.8618 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0564 2.5265 -1.5152 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8034 2.3269 0.0739 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6980 1.8702 -1.3871 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3905 -0.0230 0.4001 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8423 3.4336 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3262 3.1811 -1.8969 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4187 2.4100 -2.7066 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4677 2.7723 -0.9366 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6565 1.6888 -1.6705 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2085 -1.0367 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2441 -1.2250 -2.3741 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3084 -2.9819 -2.6847 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3253 -5.0884 -1.9101 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9496 -5.8816 0.4087 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5392 -4.5564 1.9589 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4961 -2.4502 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 22 23 2 0 12 11 2 0 15 14 2 0 24 25 2 0 19 18 2 0 25 26 1 0 18 15 1 0 26 27 2 0 27 22 1 0 19 20 1 0 15 16 1 0 11 9 1 0 16 17 1 0 9 8 1 0 12 13 1 0 8 21 1 0 9 10 2 0 21 20 1 0 7 5 1 0 19 11 1 0 5 6 2 0 21 22 1 0 5 3 1 0 3 4 1 0 8 7 1 0 3 2 1 0 14 12 1 0 2 1 1 0 23 24 1 0 14 39 1 0 18 43 1 0 8 37 1 1 21 44 1 6 23 45 1 0 24 46 1 0 25 47 1 0 26 48 1 0 27 49 1 0 17 40 1 0 17 41 1 0 17 42 1 0 13 38 1 0 3 33 1 6 4 34 1 0 4 35 1 0 4 36 1 0 2 31 1 0 2 32 1 0 1 28 1 0 1 29 1 0 1 30 1 0 M END