RDKit 3D 44 45 0 0 0 0 0 0 0 0999 V2000 5.8028 0.0995 -0.7189 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8769 0.3399 0.1955 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4655 -0.1661 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0253 -0.5307 1.4742 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5439 -1.3922 -0.7825 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6354 0.9314 -0.4916 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1117 2.1586 -0.8258 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1058 2.9046 -1.2969 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9806 2.1833 -1.2752 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2873 0.9573 -0.7798 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3906 -0.1630 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7736 -0.2049 -0.0352 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4903 -1.4500 -0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7611 -1.5487 0.6084 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3447 -2.6763 0.6898 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4605 -0.3898 1.1686 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.7693 -0.0777 0.5029 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7212 -1.2256 0.4188 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4652 0.5149 -0.8664 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6633 0.8074 1.1767 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3971 0.9590 0.5827 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7991 2.0914 0.5816 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6396 -0.4811 -1.6327 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8279 0.4748 -0.6211 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1763 0.9372 1.0584 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0117 -0.9825 1.4996 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7919 -1.2001 1.9135 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9757 0.3616 2.1309 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7898 -2.1598 -0.5716 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5578 -1.8819 -0.6618 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5366 -1.0375 -1.8536 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 2.4867 -0.7333 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 3.9400 -1.6325 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7602 -1.1075 -1.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0849 -2.3178 -0.4353 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6743 -0.6289 2.2509 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2630 0.7203 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7121 -0.8310 0.1428 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3301 -1.9838 -0.3119 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7799 -1.6828 1.4455 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7514 -0.1545 -1.3951 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9430 1.4647 -0.6742 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4042 0.6394 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0756 1.6305 1.6741 H 0 0 0 0 0 0 0 0 0 0 0 0 18 17 1 0 17 19 1 0 17 16 1 0 16 20 1 0 20 21 1 0 21 22 2 0 21 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 12 11 2 0 11 10 1 0 10 6 2 0 6 7 1 0 7 8 1 0 8 9 2 0 6 3 1 0 3 4 1 0 3 5 1 0 3 2 1 0 2 1 2 3 14 16 1 0 9 10 1 0 18 38 1 0 18 39 1 0 18 40 1 0 17 37 1 0 19 41 1 0 19 42 1 0 19 43 1 0 16 36 1 1 20 44 1 0 13 35 1 0 11 34 1 0 7 32 1 0 8 33 1 0 4 26 1 0 4 27 1 0 4 28 1 0 5 29 1 0 5 30 1 0 5 31 1 0 2 25 1 0 1 23 1 0 1 24 1 0 M END