CRX Converted by convert_cif2sdf.py 2024/03/29 11:09:15 28 28 0 0 0 0 0 0 0 0999 V2000 1.4949 1.5137 1.4118 N 0 0 0 0 0 1.9774 2.0457 2.7093 C 0 0 0 0 0 0.8322 2.7608 3.4110 C 0 0 0 0 0 2.5186 0.8934 3.5438 C 0 0 0 0 0 1.4726 -0.0742 3.7921 N 0 0 0 0 0 3.5051 0.0753 2.8409 N 0 0 0 0 0 3.1030 -1.2580 2.6841 C 0 0 0 0 0 3.6896 -2.1851 2.1535 O 0 0 0 0 0 1.7569 -1.3234 3.3232 C 0 0 0 0 0 4.7740 0.6011 2.3725 C 0 0 0 0 0 5.7846 0.4619 3.4689 C 0 0 0 0 0 5.8162 -0.4137 4.3213 O 0 0 0 0 0 1.0479 -2.4517 3.3729 C 0 0 0 0 0 3.0588 1.3716 4.7669 O 0 0 0 0 0 6.6949 1.4674 3.3911 O 0 0 0 0 0 0.6096 1.0780 1.4101 H 0 0 0 0 0 2.1572 1.4411 0.6846 H 0 0 0 0 0 2.7843 2.7573 2.5048 H 0 0 0 0 0 -0.0848 2.7069 2.8159 H 0 0 0 0 0 0.6277 2.3196 4.3932 H 0 0 0 0 0 1.0729 3.8174 3.5693 H 0 0 0 0 0 0.6145 0.1308 4.2853 H 0 0 0 0 0 4.6488 1.6575 2.1205 H 0 0 0 0 0 5.0956 0.0331 1.4959 H 0 0 0 0 0 0.0719 -2.4726 3.8437 H 0 0 0 0 0 1.4361 -3.3686 2.9444 H 0 0 0 0 0 2.3370 1.3650 5.4157 H 0 0 0 0 0 7.3724 1.4035 4.0976 H 0 0 0 0 0 1 2 1 0 0 0 1 16 1 0 0 0 1 17 1 0 0 0 2 3 1 0 0 0 2 4 1 0 0 0 2 18 1 0 0 0 3 19 1 0 0 0 3 20 1 0 0 0 3 21 1 0 0 0 4 5 1 0 0 0 4 6 1 0 0 0 4 14 1 0 0 0 5 9 1 0 0 0 5 22 1 0 0 0 6 7 1 0 0 0 6 10 1 0 0 0 7 8 2 0 0 0 7 9 1 0 0 0 9 13 2 0 0 0 10 11 1 0 0 0 10 23 1 0 0 0 10 24 1 0 0 0 11 12 2 0 0 0 11 15 1 0 0 0 13 25 1 0 0 0 13 26 1 0 0 0 14 27 1 0 0 0 15 28 1 0 0 0 M END $$$$