BL1S0J -OEChem-04012120362D 43 45 0 1 0 0 0 0 0999 V2000 7.8030 2.2247 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4141 -2.2471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8079 -1.4424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2049 0.7247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3926 -1.0800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3926 0.5294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9369 1.7247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3030 3.0907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3029 1.3587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6690 2.7247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2049 -1.2753 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0709 -0.7753 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3388 -0.7753 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3388 0.2247 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0709 0.2247 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4028 -2.3502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9369 0.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3163 -2.7569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2983 -3.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5179 -1.7758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8479 -0.4306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2489 -1.6205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2489 1.0699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0709 0.8447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1490 0.1421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5475 0.8324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0642 -3.3233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8827 -3.0091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5685 -2.1905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6817 -3.2799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2335 -3.9613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9149 -3.4095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 0.8141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 0.6769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6356 -0.1891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6356 -0.3615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 -1.2275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 -1.3647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6690 3.3447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2059 2.4147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 8 2 0 0 0 0 1 9 2 0 0 0 0 1 10 1 0 0 0 0 2 11 1 0 0 0 0 2 16 1 0 0 0 0 3 12 1 0 0 0 0 3 16 1 0 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 5 13 1 0 0 0 0 5 17 1 0 0 0 0 6 14 1 0 0 0 0 6 17 1 0 0 0 0 7 18 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 6 0 0 0 12 15 1 0 0 0 0 12 24 1 6 0 0 0 13 14 1 0 0 0 0 13 25 1 1 0 0 0 14 26 1 1 0 0 0 15 18 1 1 0 0 0 15 27 1 0 0 0 0 16 19 1 0 0 0 0 16 20 1 0 0 0 0 17 21 1 0 0 0 0 17 22 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 M END $$$$