L2QI9N -OEChem-05022323032D 41 44 0 0 0 0 0 0 0999 V2000 4.0020 -1.0855 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9452 -0.2197 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -4.0855 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.0855 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 -1.0855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 -1.0855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9726 1.4090 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 -0.0855 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9507 1.6169 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 0.4145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7816 0.0077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4507 0.7509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2294 2.0781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 -2.0855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4452 0.6464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2784 1.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4374 3.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -2.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 -2.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1144 1.3895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5352 2.4382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 3.7254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -3.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 -3.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 3.4164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 -4.0855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0279 0.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9234 -0.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4651 0.2245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9105 -0.5987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1495 1.1627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 3.2479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5991 -2.2755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 -2.2755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9855 1.9960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9456 2.2466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8231 4.3319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 -3.8955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 -4.7055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5649 1.2928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3842 -0.4266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 8 1 0 0 0 0 1 14 1 0 0 0 0 2 15 1 0 0 0 0 2 28 1 0 0 0 0 3 23 1 0 0 0 0 4 25 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 15 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 14 19 2 0 0 0 0 15 20 2 0 0 0 0 16 21 1 0 0 0 0 16 31 1 0 0 0 0 17 22 2 0 0 0 0 17 32 1 0 0 0 0 18 23 2 0 0 0 0 18 33 1 0 0 0 0 19 24 1 0 0 0 0 19 34 1 0 0 0 0 20 27 1 0 0 0 0 20 35 1 0 0 0 0 21 25 2 0 0 0 0 21 36 1 0 0 0 0 22 25 1 0 0 0 0 22 37 1 0 0 0 0 23 26 1 0 0 0 0 24 26 2 0 0 0 0 24 38 1 0 0 0 0 26 39 1 0 0 0 0 27 28 2 0 0 0 0 27 40 1 0 0 0 0 28 41 1 0 0 0 0 M END $$$$