CHEMDIV-ZINC05350449 MOE2007 3D Structure written by MMmdl. 45 47 0 0 0 0 0 0 0 0999 V2000 3.6710 2.2130 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.4240 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 1.3870 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -0.6700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 0.0580 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -2.1450 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -2.7820 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -2.8110 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -2.0470 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -0.7070 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -2.7190 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 -3.9330 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -1.9850 0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -2.6490 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0530 -1.5950 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3960 -2.2780 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0260 -2.5800 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2560 -3.2110 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8600 -3.5320 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2320 -3.2250 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0010 -2.5980 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4300 -4.3320 0.0890 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.5540 -5.0000 -1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5290 -5.0140 1.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.5840 -3.1450 0.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 2.4090 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 3.1590 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 1.6420 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9160 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 -0.4560 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -3.8880 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -1.0160 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 -3.2670 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0270 -3.2760 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 -0.9770 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9710 -0.9670 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5560 -2.3260 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7460 -3.4510 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7040 -3.4750 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5100 -2.3580 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3200 -2.2120 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5250 -3.3830 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END