2TB Converted by convert_cif2sdf.py 2024/03/29 11:09:15 27 27 0 0 0 0 0 0 0 0999 V2000 1.1133 1.1244 -0.4172 C 0 0 0 0 0 -0.2168 1.7152 0.0546 C 0 0 0 0 0 -1.3670 0.8245 -0.4191 C 0 0 0 0 0 -1.1978 -0.5798 0.1647 C 0 0 0 0 0 0.1324 -1.1716 -0.3071 C 0 0 0 0 0 1.2835 -0.2798 0.1655 C 0 0 0 0 0 2.2179 1.9800 0.0368 N 0 3 0 0 0 -2.6434 1.3915 0.0341 N 0 3 0 0 0 0.2909 -2.4829 0.2375 O 0 0 0 0 0 -2.2717 -1.4120 -0.2776 O 0 0 0 0 0 2.5251 -0.8322 -0.2749 O 0 0 0 0 0 1.1207 1.0690 -1.5066 H 0 0 0 0 0 -0.2231 1.7707 1.1430 H 0 0 0 0 0 -0.3372 2.7153 -0.3613 H 0 0 0 0 0 -1.3596 0.7691 -1.5075 H 0 0 0 0 0 -1.2042 -0.5243 1.2531 H 0 0 0 0 0 0.1396 -1.2260 -1.3956 H 0 0 0 0 0 1.2761 -0.2244 1.2539 H 0 0 0 0 0 2.2111 2.0305 1.0443 H 0 0 0 0 0 2.1062 2.9060 -0.3482 H 0 0 0 0 0 3.0949 1.5895 -0.2751 H 0 0 0 0 0 -2.7560 2.3174 -0.3499 H 0 0 0 0 0 -3.4028 0.8045 -0.2774 H 0 0 0 0 0 -2.6502 1.4430 1.0426 H 0 0 0 0 0 1.1391 -2.8182 -0.0842 H 0 0 0 0 0 -2.1272 -2.2852 0.1119 H 0 0 0 0 0 2.5922 -1.7154 0.1135 H 0 0 0 0 0 1 2 1 0 0 0 1 6 1 0 0 0 1 7 1 0 0 0 1 12 1 0 0 0 2 3 1 0 0 0 2 13 1 0 0 0 2 14 1 0 0 0 3 4 1 0 0 0 3 8 1 0 0 0 3 15 1 0 0 0 4 5 1 0 0 0 4 10 1 0 0 0 4 16 1 0 0 0 5 6 1 0 0 0 5 9 1 0 0 0 5 17 1 0 0 0 6 11 1 0 0 0 6 18 1 0 0 0 7 19 1 0 0 0 7 20 1 0 0 0 7 21 1 0 0 0 8 22 1 0 0 0 8 23 1 0 0 0 8 24 1 0 0 0 9 25 1 0 0 0 10 26 1 0 0 0 11 27 1 0 0 0 M END $$$$