RDKit 3D 49 51 0 0 0 0 0 0 0 0999 V2000 4.9038 0.7701 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4663 0.9060 0.0709 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3512 0.0447 0.9229 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0342 0.6173 0.2323 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3548 0.1259 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0048 -0.1703 -0.7691 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3343 0.0194 0.4192 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0548 0.5185 1.5139 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4004 0.8205 1.4339 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 1.3122 2.4951 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1126 -0.2856 0.6108 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1633 -1.6839 1.1819 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6687 0.7378 1.5496 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0423 1.2016 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8871 0.1169 0.5735 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2707 -0.4169 -0.6936 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6843 -1.8361 -0.9253 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8874 0.3986 -1.8404 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8014 -0.1667 -0.7226 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1179 -0.9558 -1.7767 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 -1.8137 -2.4831 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3014 -0.6826 -1.9665 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8883 -0.8670 -3.0621 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8508 -0.2822 -1.7204 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2703 1.3665 -2.0596 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9553 1.1157 -1.4898 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6583 1.9605 0.3564 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9148 -0.6385 0.2569 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7912 -0.6199 1.6147 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1191 0.6455 1.4625 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8212 -0.0434 -1.8205 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5746 0.6864 2.4725 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1038 1.5316 2.4072 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0921 -1.9365 1.6852 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8222 -2.3928 0.4079 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3627 -1.7070 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0058 1.6463 1.5819 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7326 0.3553 2.6107 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5966 1.5599 2.0923 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0492 2.0540 0.4669 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 0.5788 0.3544 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1077 -0.7012 1.3037 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9558 -2.5993 -0.6545 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6286 -2.0555 -0.3685 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9622 -2.0237 -2.0045 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7496 0.9987 -1.5067 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 1.1279 -2.2564 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -0.2615 -2.6956 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 0.9235 -1.0071 H 0 0 0 0 0 0 0 0 0 0 0 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 2 0 22 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 9 4 1 0 4 5 2 0 4 2 1 0 2 1 1 0 2 3 1 0 7 11 1 0 11 12 1 1 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 6 16 18 1 0 11 19 1 0 16 19 1 0 5 6 1 0 19 49 1 6 8 32 1 0 10 33 1 0 5 31 1 0 2 27 1 1 1 24 1 0 1 25 1 0 1 26 1 0 3 28 1 0 3 29 1 0 3 30 1 0 12 34 1 0 12 35 1 0 12 36 1 0 13 37 1 0 13 38 1 0 14 39 1 0 14 40 1 0 15 41 1 0 15 42 1 0 17 43 1 0 17 44 1 0 17 45 1 0 18 46 1 0 18 47 1 0 18 48 1 0 M END