BJ7QR5 -OEChem-04022104582D 35 37 0 0 0 0 0 0 0999 V2000 5.5116 3.2088 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.3844 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9595 5.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 3.8475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 4.8180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 4.6101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 3.9520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -0.8018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.4921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.9256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.9256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.3056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.3056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 3.4256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.5744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.5744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.1944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.1944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9329 5.3844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 23 1 0 0 0 0 2 22 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 21 2 0 0 0 0 5 23 2 0 0 0 0 6 21 1 0 0 0 0 6 23 1 0 0 0 0 6 35 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 7 15 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 17 2 0 0 0 0 10 18 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 12 14 2 0 0 0 0 12 27 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 21 1 0 0 0 0 17 19 1 0 0 0 0 17 31 1 0 0 0 0 18 20 2 0 0 0 0 18 32 1 0 0 0 0 19 22 2 0 0 0 0 19 33 1 0 0 0 0 20 22 1 0 0 0 0 20 34 1 0 0 0 0 M END $$$$