RDKit 3D 47 50 0 0 0 0 0 0 0 0999 V2000 -1.8030 0.6253 -2.0801 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -0.6840 -1.4949 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3684 -1.6964 -2.0661 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5925 -1.0866 -1.7398 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8289 -2.3467 -1.0123 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3051 -1.1591 -0.4714 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4271 -0.3692 0.4622 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5743 0.9830 0.2273 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5316 -0.7664 1.8623 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4376 -0.6790 2.6041 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2269 -0.2299 2.0926 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0566 0.0285 0.6803 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2691 -0.1726 0.3207 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9499 0.9554 -0.0570 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9383 1.1783 0.9079 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 0.0893 1.0227 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9158 0.4957 1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7759 -0.6217 2.0546 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4031 -0.2469 -0.3184 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8143 -1.3811 -0.8801 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0808 0.9154 -1.2498 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4565 2.1263 -0.6677 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5748 0.9101 -1.4095 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2567 2.0348 -2.1831 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0485 -0.8158 -0.0176 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6313 1.4558 -1.3963 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6518 0.9096 -2.7731 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9405 0.4951 -2.7801 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7081 -2.5691 -1.7094 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0326 -1.0330 -2.7247 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3759 -0.9901 -0.3796 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4740 1.1875 -0.1639 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4212 -1.1234 2.3399 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4386 -0.9556 3.6493 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3153 1.0969 0.5702 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2727 1.8366 -0.0055 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2887 -0.7832 1.4935 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5315 0.6346 3.0081 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 1.4037 1.6494 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7262 -0.3445 2.0547 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4876 -0.3502 -0.2011 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4288 -1.8781 -1.4777 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6136 0.7688 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4538 2.1424 -0.6351 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2698 0.0210 -2.0051 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5501 1.8774 -3.1152 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9611 -1.8892 0.3107 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 6 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 1 7 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 16 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 12 25 1 0 25 2 1 0 6 4 1 0 25 7 1 0 23 14 1 0 1 26 1 0 1 27 1 0 1 28 1 0 3 29 1 0 4 30 1 6 6 31 1 6 8 32 1 0 9 33 1 0 10 34 1 0 12 35 1 1 14 36 1 6 16 37 1 1 17 38 1 0 17 39 1 0 18 40 1 0 19 41 1 1 20 42 1 0 21 43 1 6 22 44 1 0 23 45 1 6 24 46 1 0 25 47 1 6 M END