B3QRP5 -OEChem-04022109372D 49 50 0 0 0 0 0 0 0999 V2000 10.0021 6.2150 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 5.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 8.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 10.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 8.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 1.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 0.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 1.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 7.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 6.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 7.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 7.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 4.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 5.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 6.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 9.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 3.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 3.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 10.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 10.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 11.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 10.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 12.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 11.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 7.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 7.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 5.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 6.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 9.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 9.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 12.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0021 10.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 12.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 9.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 8.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0021 12.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9399 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0021 6.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 49 1 0 0 0 0 2 10 1 0 0 0 0 2 13 1 0 0 0 0 3 9 1 0 0 0 0 3 19 1 0 0 0 0 3 33 1 0 0 0 0 4 19 2 0 0 0 0 4 22 1 0 0 0 0 5 19 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 18 1 0 0 0 0 6 28 2 0 0 0 0 7 28 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 28 1 0 0 0 0 8 47 1 0 0 0 0 8 48 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 29 1 0 0 0 0 12 15 2 0 0 0 0 12 30 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 16 20 1 0 0 0 0 16 34 1 0 0 0 0 17 21 2 0 0 0 0 17 35 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 38 1 0 0 0 0 24 26 2 0 0 0 0 24 39 1 0 0 0 0 25 27 2 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 44 1 0 0 0 0 M END $$$$