B30BQV -OEChem-04022116573D 27 29 0 0 0 0 0 0 0999 V2000 -4.5716 1.9420 0.0011 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6209 -0.0742 0.0023 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3984 0.8246 -0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6758 -1.3806 -0.0004 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0864 1.2924 -0.0006 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8671 0.2965 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6672 -1.0811 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2849 -0.2161 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 0.8876 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -1.9350 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2304 0.0227 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7122 -0.0052 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0618 -1.3638 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5942 -1.0713 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5742 0.5810 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9551 -0.7865 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4172 1.5304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3829 0.5366 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6298 1.8094 -0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 1.9681 -0.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6622 -3.0135 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9223 -2.0293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2595 -2.1034 0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6813 -1.5938 0.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6987 2.5782 -0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4386 0.7821 0.0015 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4814 2.3087 0.0027 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 27 1 0 0 0 0 2 15 2 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 3 19 1 0 0 0 0 4 7 1 0 0 0 0 4 8 2 0 0 0 0 5 12 1 0 0 0 0 5 17 2 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 10 1 0 0 0 0 8 12 1 0 0 0 0 9 11 2 0 0 0 0 9 20 1 0 0 0 0 10 13 2 0 0 0 0 10 21 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 12 14 2 0 0 0 0 13 22 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 18 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 26 1 0 0 0 0 M END $$$$