RDKit 3D 48 51 0 0 0 0 0 0 0 0999 V2000 3.4191 -2.1682 2.4945 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7706 -1.4950 1.4612 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8466 -0.1148 1.2611 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5925 0.6826 2.1033 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6486 2.0397 1.8817 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3876 2.8724 2.7071 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9497 2.5600 0.8136 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 1.7886 -0.0452 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1436 0.4287 0.1824 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -0.4035 -0.7177 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0066 -0.5417 -0.3181 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8367 -0.6252 -1.4314 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1131 -0.2574 -2.5265 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6954 -0.2468 -3.7895 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0117 -0.6118 -3.9243 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -0.9879 -2.8534 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1269 -1.3646 -2.9809 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1679 -0.9894 -1.6037 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9774 -1.3921 -0.4343 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3835 -0.2074 0.3645 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1069 -0.0274 1.6439 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5277 1.1694 2.4107 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3445 -1.0795 2.3566 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2763 0.0863 -2.1180 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5124 1.5293 -2.3324 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4836 2.3188 -1.1344 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9005 -3.1556 2.6701 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4918 -2.4167 2.2478 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4516 -1.6321 3.4617 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1318 0.2132 2.9417 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4338 3.8709 2.5512 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9868 3.6439 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7777 -1.4461 -0.6596 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1111 0.0488 -4.6634 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4904 -0.6112 -4.9041 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5129 -1.3437 -3.9175 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8792 -1.9258 -0.7938 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4239 -2.1127 0.2188 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 0.5936 -0.1258 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5079 2.0969 1.8129 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8481 1.3303 3.2714 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5603 0.9603 2.8133 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0216 -1.9860 2.3477 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4269 -1.3939 1.8489 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1691 -0.8037 3.4209 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0119 -0.5005 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 1.9346 -3.0397 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 1.6723 -2.8602 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 5 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 16 18 2 0 18 19 1 0 19 20 1 0 20 21 2 3 21 22 1 0 21 23 1 0 13 24 1 0 24 25 1 0 25 26 1 0 9 3 1 0 24 10 1 0 26 8 1 0 18 12 1 0 1 27 1 0 1 28 1 0 1 29 1 0 4 30 1 0 6 31 1 0 7 32 1 0 10 33 1 6 14 34 1 0 15 35 1 0 17 36 1 0 19 37 1 0 19 38 1 0 20 39 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 6 25 47 1 0 25 48 1 0 M END