B5V9WB -OEChem-04022102482D 84 85 0 1 0 0 0 0 0999 V2000 8.5991 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4651 1.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.0632 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2690 1.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2690 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1972 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3933 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2594 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3933 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1254 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1254 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2594 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0193 0.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0193 2.5347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9254 0.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9254 2.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2753 -1.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6738 -0.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3967 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1938 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0598 1.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2628 1.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1288 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9258 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9851 -0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5866 -1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6412 1.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0212 3.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 3.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 1.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4450 1.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 3.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2471 -0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4871 -0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2594 -0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2594 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0122 -0.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0122 3.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4611 0.6671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4611 2.3329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19 1 1 6 0 0 0 1 77 1 0 0 0 0 2 17 2 0 0 0 0 3 23 2 0 0 0 0 4 27 2 0 0 0 0 5 32 1 0 0 0 0 5 81 1 0 0 0 0 6 35 1 0 0 0 0 6 84 1 0 0 0 0 7 32 2 0 0 0 0 8 35 2 0 0 0 0 13 9 1 1 0 0 0 9 16 1 0 0 0 0 9 47 1 0 0 0 0 14 10 1 6 0 0 0 10 17 1 0 0 0 0 10 53 1 0 0 0 0 11 23 1 0 0 0 0 24 11 1 1 0 0 0 11 61 1 0 0 0 0 20 12 1 6 0 0 0 12 27 1 0 0 0 0 12 62 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 13 43 1 0 0 0 0 14 19 1 0 0 0 0 14 23 1 0 0 0 0 14 44 1 0 0 0 0 15 25 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 18 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 18 22 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 28 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 54 1 0 0 0 0 21 29 1 0 0 0 0 21 30 1 0 0 0 0 21 55 1 0 0 0 0 22 26 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 24 27 1 0 0 0 0 24 31 1 0 0 0 0 24 58 1 0 0 0 0 25 35 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 33 2 0 0 0 0 26 34 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 66 1 0 0 0 0 29 67 1 0 0 0 0 29 68 1 0 0 0 0 30 69 1 0 0 0 0 30 70 1 0 0 0 0 30 71 1 0 0 0 0 31 72 1 0 0 0 0 31 73 1 0 0 0 0 31 74 1 0 0 0 0 33 36 1 0 0 0 0 33 75 1 0 0 0 0 34 38 2 0 0 0 0 34 76 1 0 0 0 0 36 37 1 0 0 0 0 36 39 2 0 0 0 0 37 38 1 0 0 0 0 37 40 2 0 0 0 0 38 78 1 0 0 0 0 39 41 1 0 0 0 0 39 79 1 0 0 0 0 40 42 1 0 0 0 0 40 80 1 0 0 0 0 41 42 2 0 0 0 0 41 82 1 0 0 0 0 42 83 1 0 0 0 0 M END $$$$