B0W6UZ -OEChem-04012114512D 57 60 0 1 0 0 0 0 0999 V2000 4.9889 3.0427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -0.4446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 -0.4446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 -2.1767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 1.2874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 1.2874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 1.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 2.1535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 2.1535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 1.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 2.0922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 0.4214 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7619 -1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7619 -1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7619 -3.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9519 1.8244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1793 0.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8695 -0.1892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8695 2.7640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1793 2.3655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6542 -0.1892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3445 0.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3445 2.3655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6542 2.7640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8445 1.4995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1542 1.8980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 -0.0842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2156 0.1735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1419 0.4214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3445 0.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6542 1.0320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.9074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.4774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.0974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5719 -0.9815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4519 0.9583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0719 -1.8476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0719 0.9583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8819 -0.4446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2249 -3.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0719 -3.5796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2988 -2.7327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 17 1 0 0 0 0 2 50 1 0 0 0 0 3 18 1 0 0 0 0 3 23 1 0 0 0 0 4 24 1 0 0 0 0 4 29 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 11 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 17 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 15 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 16 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 20 2 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 21 1 0 0 0 0 19 46 1 0 0 0 0 20 22 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 26 2 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 26 28 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 M END $$$$