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RDKit 2D
0 0 0 0 0 0 0 0 0 0999 V3000
M V30 BEGIN CTAB
M V30 COUNTS 17 18 1 0 0
M V30 BEGIN ATOM
M V30 1 N -3.300000 -0.729200 0.000000 0
M V30 2 C -2.520800 -0.304200 0.000000 0
M V30 3 N -4.062500 0.600000 0.000000 0
M V30 4 N -2.512500 0.595800 0.000000 0
M V30 5 C -4.062500 -0.279200 0.000000 0
M V30 6 S -1.745800 -0.750000 0.000000 0
M V30 7 O 1.337500 -0.729200 0.000000 0
M V30 8 C -0.200000 -0.729200 0.000000 0
M V30 9 C -0.983300 -0.287500 0.000000 0
M V30 10 C 0.554200 -0.287500 0.000000 0
M V30 11 C 2.116700 -0.266700 0.000000 0
M V30 12 O -0.200000 -1.604200 0.000000 0
M V30 13 C 2.966700 -0.716700 0.000000 0
M V30 14 C 2.079200 0.683300 0.000000 0
M V30 15 C 2.879200 1.183300 0.000000 0
M V30 16 C 3.754200 -0.200000 0.000000 0
M V30 17 C 3.716700 0.750000 0.000000 0
M V30 END ATOM
M V30 BEGIN BOND
M V30 1 2 2 1
M V30 2 2 3 5
M V30 3 1 4 2
M V30 4 1 5 1
M V30 5 1 6 2
M V30 6 1 7 10
M V30 7 1 8 9
M V30 8 1 9 6
M V30 9 1 10 8
M V30 10 1 11 7
M V30 11 1 12 8
M V30 12 2 13 11
M V30 13 1 14 11
M V30 14 2 15 14
M V30 15 1 16 13
M V30 16 1 17 15
M V30 17 1 3 4
M V30 18 2 17 16
M V30 END BOND
M V30 BEGIN SGROUP
M V30 1 DAT 1 ATOMS=(1 8) FIELDNAME=IDBS_STEREO -
M V30 FIELDDISP=" -0.3170 -1.2042 DA ALL 1 5"
M V30 END SGROUP
M V30 END CTAB
M END
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