B1V4ZS -OEChem-04022108222D 59 61 0 1 0 0 0 0 0999 V2000 4.2690 -1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 4.4050 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 11.1972 2.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -4.0950 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 12.0632 -2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 3.4050 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.1972 -3.0950 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.2690 -3.0950 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4030 -2.5950 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1350 -2.5950 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4030 -1.5950 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1350 -1.5950 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5369 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.4050 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7331 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9264 -0.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3249 -1.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 0.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3905 -0.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -2.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3437 -0.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9451 0.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 1.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 4.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 -1.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 19 2 1 6 0 0 0 2 21 1 0 0 0 0 15 3 1 1 0 0 0 3 43 1 0 0 0 0 16 4 1 6 0 0 0 4 46 1 0 0 0 0 17 5 1 1 0 0 0 5 47 1 0 0 0 0 6 20 1 0 0 0 0 6 49 1 0 0 0 0 7 22 1 0 0 0 0 7 24 1 0 0 0 0 8 23 1 0 0 0 0 8 25 1 0 0 0 0 9 13 1 0 0 0 0 10 13 2 0 0 0 0 11 14 1 0 0 0 0 12 14 2 0 0 0 0 13 32 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 16 18 1 0 0 0 0 16 37 1 0 0 0 0 17 19 1 0 0 0 0 17 38 1 0 0 0 0 18 20 1 1 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 25 30 2 0 0 0 0 25 31 1 0 0 0 0 26 28 1 0 0 0 0 26 52 1 0 0 0 0 27 29 2 0 0 0 0 27 53 1 0 0 0 0 28 32 2 0 0 0 0 28 54 1 0 0 0 0 29 32 1 0 0 0 0 29 55 1 0 0 0 0 30 33 1 0 0 0 0 30 56 1 0 0 0 0 31 34 2 0 0 0 0 31 57 1 0 0 0 0 33 35 2 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 M CHG 4 9 -1 11 -1 13 1 14 1 M END $$$$