RDKit 3D 50 52 0 0 0 0 0 0 0 0999 V2000 2.0694 0.2372 3.4421 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7262 0.6194 2.2688 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0905 0.5927 1.0482 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7651 0.1923 0.8865 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1502 0.1742 -0.3524 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2727 -0.2642 -0.4876 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2861 -1.5339 -1.3000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9496 -1.3753 -2.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0165 -2.6567 -0.5891 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3471 -2.1750 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2534 -1.0622 0.6714 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1989 -0.2010 1.3886 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2742 0.4767 2.4023 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0322 0.6540 1.6573 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1862 1.8616 0.8771 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -0.5244 0.8657 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8938 0.5708 -1.4549 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3208 0.5768 -2.7963 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2691 1.5428 -3.2997 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2067 0.9728 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9131 1.3571 -2.4282 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6663 0.5311 -3.2655 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8072 0.9855 -0.0876 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 1.3910 0.0329 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1491 0.4350 -0.0733 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2522 0.9522 3.7452 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7622 0.2301 4.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5757 -0.7372 3.2748 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -0.0967 1.7853 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8364 0.5071 -1.0504 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2742 -1.9137 -1.5378 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8366 -0.9527 -2.4074 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2032 -3.4488 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3869 -3.0658 0.2171 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2856 -2.6324 -0.2772 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0384 -0.7185 1.8692 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5805 0.5579 0.6699 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1433 -0.1288 3.3044 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6916 1.4952 2.6401 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9627 1.7728 0.0845 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2282 2.2633 0.4964 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5861 2.6463 1.5785 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3015 -1.3134 1.3771 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4061 -0.3230 -3.4193 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6538 0.9930 -4.2854 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3736 -0.5211 -3.2906 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7366 0.6222 -2.9358 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3853 -0.0614 0.9098 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9253 -0.3895 -0.7677 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1098 0.8842 -0.4269 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 6 16 1 0 16 14 1 0 14 15 1 0 14 13 1 0 13 12 1 0 12 11 1 0 11 10 2 0 10 9 1 0 9 7 1 0 7 8 1 0 5 17 2 0 17 18 1 0 18 19 2 0 17 20 1 0 20 21 1 0 21 22 1 0 20 23 2 0 23 24 1 0 24 25 1 0 23 3 1 0 7 6 1 0 11 16 1 0 1 26 1 0 1 27 1 0 1 28 1 0 4 29 1 0 6 30 1 6 16 43 1 1 15 40 1 0 15 41 1 0 15 42 1 0 13 38 1 0 13 39 1 0 12 36 1 0 12 37 1 0 10 35 1 0 9 33 1 0 9 34 1 0 7 31 1 6 8 32 1 0 18 44 1 0 22 45 1 0 22 46 1 0 22 47 1 0 25 48 1 0 25 49 1 0 25 50 1 0 M END