DTR Converted by convert_cif2sdf.py 2024/03/29 11:09:15 27 28 0 0 0 0 0 0 0 0999 V2000 -0.0191 2.3981 3.6863 N 0 0 0 0 0 -0.8912 1.2661 3.4987 C 0 0 0 0 0 -1.7748 1.0361 4.7479 C 0 0 0 0 0 -3.0147 0.2822 4.4788 C 0 0 0 0 0 -3.1528 -1.0853 4.5356 C 0 0 0 0 0 -4.4500 -1.3921 4.2219 N 0 0 0 0 0 -5.1599 -0.2418 3.9603 C 0 0 0 0 0 -6.5017 -0.0689 3.6036 C 0 0 0 0 0 -6.9536 1.2371 3.3987 C 0 0 0 0 0 -6.0960 2.3255 3.5474 C 0 0 0 0 0 -4.7561 2.1384 3.9048 C 0 0 0 0 0 -4.2782 0.8298 4.1161 C 0 0 0 0 0 -0.0962 0.0155 3.1529 C 0 0 0 0 0 1.0159 -0.2167 3.6157 O 0 0 0 0 0 -0.7132 -0.8323 2.2958 O 0 0 0 0 0 0.7493 2.3204 4.3302 H 0 0 0 0 0 -0.3044 3.2973 3.3360 H 0 0 0 0 0 -1.5102 1.5020 2.6255 H 0 0 0 0 0 -1.1760 0.5075 5.5182 H 0 0 0 0 0 -1.9923 2.0205 5.2130 H 0 0 0 0 0 -2.4461 -1.8691 4.7708 H 0 0 0 0 0 -4.8322 -2.3274 4.1861 H 0 0 0 0 0 -7.1710 -0.9159 3.4891 H 0 0 0 0 0 -7.9909 1.4061 3.1204 H 0 0 0 0 0 -6.4701 3.3323 3.3835 H 0 0 0 0 0 -4.1000 2.9962 4.0160 H 0 0 0 0 0 -0.2036 -1.6406 2.0778 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 13 1 0 0 0 2 18 1 0 0 0 3 4 1 0 0 0 3 19 1 0 0 0 3 20 1 0 0 0 4 5 2 0 0 0 4 12 1 0 0 0 5 6 1 0 0 0 5 21 1 0 0 0 6 7 1 0 0 0 6 22 1 0 0 0 7 8 2 0 0 0 7 12 1 0 0 0 8 9 1 0 0 0 8 23 1 0 0 0 9 10 2 0 0 0 9 24 1 0 0 0 10 11 1 0 0 0 10 25 1 0 0 0 11 12 2 0 0 0 11 26 1 0 0 0 13 14 2 0 0 0 13 15 1 0 0 0 15 27 1 0 0 0 M END $$$$