B1R2OA -OEChem-04012118272D 45 48 0 0 0 0 0 0 0999 V2000 5.9209 4.2998 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 2.8112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.1117 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.3070 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3070 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1930 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6930 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -2.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2673 -2.7546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9801 -2.1948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3587 -3.7504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4945 -3.0523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1942 -4.2998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1447 -3.9892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.4977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 1.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 1.6545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 2.1926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 2.6050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 3.1431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 3.3493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3875 -1.9118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9484 -2.2229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 -2.9472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5694 -2.0022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9235 -1.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7442 -3.6682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1418 -4.3312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0125 -3.3930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9419 -2.6231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7468 -4.7291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5131 -4.8315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2014 -4.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7593 -4.0713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.1170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 1.1930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7144 2.0647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 2.0030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.0030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2177 3.6046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6707 2.3497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 23 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 15 1 0 0 0 0 4 17 2 0 0 0 0 5 15 2 0 0 0 0 5 20 1 0 0 0 0 6 18 1 0 0 0 0 6 20 2 0 0 0 0 7 18 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 17 19 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 39 1 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 22 24 2 0 0 0 0 22 41 1 0 0 0 0 23 25 2 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 M END $$$$