IBS-ZINC06760530 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.3580 0.3160 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -1.1660 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 -1.3180 0.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -1.4930 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -1.6450 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2450 -1.6140 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4520 -1.7450 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 -1.4180 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -1.2800 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -1.1000 2.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -1.0620 3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -1.2050 3.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3920 -1.3740 2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -1.1310 5.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -0.5330 5.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -0.9000 5.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 -1.8350 -2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -1.7690 -3.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2140 -2.0830 -2.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7420 -2.3610 -3.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1990 -1.7680 -4.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5720 -3.8480 -4.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0500 -4.0730 -5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -4.1840 -4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -4.6830 -3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2050 -2.0020 -3.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7960 -1.7330 -2.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8570 -1.9800 -5.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2480 -1.5270 -5.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7470 -1.6000 -6.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7750 -2.9630 -7.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 0.4290 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.7040 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 0.8690 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -1.7190 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -1.5550 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -1.5160 -1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -0.9890 2.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 -1.4840 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 0.5510 5.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -0.9430 6.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8090 -2.0770 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -4.0560 -3.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9600 -5.2160 -4.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -3.5180 -5.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2820 -4.4440 -3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0990 -5.7420 -3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7420 -4.4580 -2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4040 -2.2650 -5.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8660 -2.1660 -4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3110 -0.4980 -4.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7510 -1.1800 -6.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0760 -1.0310 -7.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0820 -3.0850 -8.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 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 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 M END