OTAVA-ZINC01940990 MOE2007 3D Structure written by MMmdl. 52 56 0 0 0 0 0 0 0 0999 V2000 2.3800 1.4220 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 1.3980 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 1.2440 -0.6840 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 0.0620 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -2.0890 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -2.7890 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -2.1380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.7550 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -0.0690 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 0.2920 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 0.0410 -2.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4890 0.9690 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 1.3480 -2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4140 1.9780 -2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9230 2.2430 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2180 1.8730 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 1.2310 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2950 0.8640 1.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 0.2450 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 -0.1190 2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 0.9370 2.8920 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 -0.3630 3.4820 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 -1.2680 2.2960 F 0 0 0 0 0 0 0 0 0 0 0 0 -8.1200 2.8700 -0.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7980 3.2270 -1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0990 3.9070 -1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2520 3.1600 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4450 3.7840 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4870 5.1560 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3340 5.9050 -1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1410 5.2800 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7650 5.8250 -0.6280 N 0 3 0 0 0 0 0 0 0 0 0 0 -13.8020 7.0350 -0.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.7800 5.1660 -0.4940 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2970 1.9920 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9280 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -0.4420 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -2.6140 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -3.8680 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -2.7160 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8200 1.1450 -3.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9740 2.2730 -2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6200 2.0820 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1720 3.9050 -2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9980 2.3280 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2210 2.0880 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3450 3.1990 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3670 6.9770 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2400 5.8650 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 51 1 0 0 0 0 33 52 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 M CHG 1 34 1 M CHG 1 36 -1 M END