BABI90 -OEChem-04022100342D 41 44 0 1 0 0 0 0 0999 V2000 4.6870 -0.7155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1111 1.8072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6166 -0.9905 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1448 -2.1135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6005 -2.3088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7284 0.4233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4666 -0.8088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3326 -2.3088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5179 0.8936 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6005 -0.3088 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4960 0.6857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0179 0.0276 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0233 -0.0769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3326 -0.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4666 -1.8088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1986 -0.8088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1986 -1.8088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1448 -0.5041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7284 -1.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7284 -1.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2284 -0.4428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2284 -2.1748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2284 -0.4428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2284 -2.1748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7284 -1.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 1.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5681 -0.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 0.6857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5608 1.3023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7957 -0.5512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0666 0.5416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4218 0.0731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3326 0.3112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4756 2.3088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3374 0.0853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9184 0.0942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9184 -2.7118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5384 -2.7118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3484 -1.3088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3484 0.4233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 9 2 1 1 0 0 0 2 34 1 0 0 0 0 3 13 1 0 0 0 0 3 36 1 0 0 0 0 4 17 1 0 0 0 0 4 19 1 0 0 0 0 5 15 2 0 0 0 0 6 23 1 0 0 0 0 6 41 1 0 0 0 0 10 7 1 6 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 8 15 1 0 0 0 0 8 17 2 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 6 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 16 2 0 0 0 0 14 33 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 37 1 0 0 0 0 22 24 2 0 0 0 0 22 38 1 0 0 0 0 23 25 2 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$