RDKit 3D 42 46 0 0 0 0 0 0 0 0999 V2000 -4.5068 -0.1541 1.5957 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4547 -0.5539 0.7385 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 0.4145 0.1348 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8655 1.7542 0.3213 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0631 2.7070 -0.3011 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 2.2714 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8315 0.9387 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6405 0.0165 -0.7082 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4465 -1.4178 -0.9216 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9881 -2.1906 0.1068 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0425 -1.8546 -1.1631 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0938 -2.8743 -2.1584 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4849 -2.5878 0.0392 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4694 -2.1838 0.8101 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1291 -0.9285 0.4945 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0645 -0.2948 1.3034 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5098 0.9790 0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5075 1.6433 1.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0164 1.6083 -0.1489 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0869 1.0181 -0.9845 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7066 -0.2437 -0.5898 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8536 -0.8142 -1.6586 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2520 0.4596 -2.1991 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3943 1.3626 -2.1622 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9108 -1.0651 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3305 0.2955 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1647 0.5998 2.3487 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6625 2.0637 0.9708 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 3.7494 -0.1507 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4359 3.0519 -1.6024 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0448 -1.6696 -1.8499 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8365 -2.6118 -0.1763 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5899 -3.6525 -1.8244 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0211 -3.5412 0.2642 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8225 -2.7326 1.6726 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4032 -0.8480 2.1675 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9428 0.9148 2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0007 2.4894 2.3513 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3116 2.0996 1.2061 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3576 2.6175 -0.4176 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5579 -1.1970 -2.4488 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0057 0.3607 -3.2592 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 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 6 11 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 23 24 1 0 8 3 1 0 22 11 1 0 23 7 1 0 21 15 1 0 24 20 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 5 29 1 0 6 30 1 0 9 31 1 6 10 32 1 0 12 33 1 0 13 34 1 0 14 35 1 0 16 36 1 0 18 37 1 0 18 38 1 0 18 39 1 0 19 40 1 0 22 41 1 6 23 42 1 6 M END