B78XTR -OEChem-04012116312D 40 43 0 0 0 0 0 0 0999 V2000 2.0000 1.4119 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8718 2.9086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.1156 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.3844 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.8844 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3468 -2.8180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3686 -2.6101 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 1.9086 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5320 0.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 1.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 -0.1502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 1.9191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.4052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -1.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 1.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1776 -1.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8468 -1.9520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 1.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 2.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8413 -1.8475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 1.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 3.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 2.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -0.7702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8611 -1.4256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 2.5390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1963 0.0515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3066 -0.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 0.7644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5932 3.1944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5990 -3.3844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9061 -2.4641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4579 -1.7827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7765 -1.2309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3991 1.5744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 4.0044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3991 3.1944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 2 8 2 0 0 0 0 3 10 1 0 0 0 0 3 16 1 0 0 0 0 3 28 1 0 0 0 0 4 10 2 0 0 0 0 4 12 1 0 0 0 0 5 11 1 0 0 0 0 5 12 2 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 34 1 0 0 0 0 7 16 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 13 1 0 0 0 0 11 14 1 0 0 0 0 12 17 1 0 0 0 0 13 18 2 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 17 21 2 0 0 0 0 17 22 1 0 0 0 0 18 30 1 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 20 23 1 0 0 0 0 21 24 1 0 0 0 0 21 32 1 0 0 0 0 22 25 2 0 0 0 0 22 33 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 26 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 M CHG 2 1 -1 8 1 M END $$$$