RDKit 3D 39 40 0 0 0 0 0 0 0 0999 V2000 -4.9137 -0.9022 -0.5596 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4579 -0.5280 -0.4335 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -1.4557 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1167 -1.1752 -0.7989 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7333 0.0446 -0.2755 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6972 0.9664 0.1576 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0623 0.7107 0.1182 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0706 1.7272 0.5732 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0655 2.1132 0.6297 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3086 1.9919 0.5659 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 2.7342 1.0649 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6391 0.6315 -0.1088 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5552 -0.1613 0.8046 N 0 0 0 0 0 4 0 0 0 0 0 0 2.8502 -0.6970 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5034 -1.7720 -0.8324 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6354 -1.3430 1.3516 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6522 0.4623 -0.4541 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6482 0.6579 -1.6652 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2156 1.3866 0.3787 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4714 -0.1082 -1.0664 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0439 -1.8151 -1.1506 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3437 -1.0788 0.4312 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8015 -2.4096 -1.2953 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4056 -1.9026 -1.1757 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9274 1.2481 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6492 2.4123 1.3149 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4231 2.3120 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5324 2.9117 1.0424 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1153 0.8206 -1.0742 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8302 0.5123 1.5381 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0154 -0.8971 1.2739 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8982 -2.5728 -0.3934 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4161 -2.2278 -1.2344 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9557 -1.3617 -1.6871 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1125 -2.2213 1.7475 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7858 -0.6526 2.1888 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -1.6666 1.0126 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7339 2.1264 -0.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5621 1.1785 1.3073 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 6 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 14 17 1 0 17 18 2 0 17 19 1 0 7 2 1 0 12 5 1 0 1 20 1 0 1 21 1 0 1 22 1 0 3 23 1 0 4 24 1 0 8 25 1 0 8 26 1 0 8 27 1 0 9 28 1 0 12 29 1 6 13 30 1 0 13 31 1 0 15 32 1 0 15 33 1 0 15 34 1 0 16 35 1 0 16 36 1 0 16 37 1 0 19 38 1 0 19 39 1 0 M CHG 1 13 1 M END