PUBCHEM-ZINC00877575 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.0170 1.4110 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0180 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -0.6450 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 0.1010 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -0.5390 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 -1.9200 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -2.6650 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -2.0300 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -4.1700 0.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5940 -4.5760 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 -4.6770 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 -6.1830 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -6.7910 0.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 -6.8530 2.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 -8.2520 2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 -8.9730 1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -10.3530 1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -11.0170 2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 -10.3020 3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -8.9210 3.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 -12.7780 2.5800 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4020 -13.1380 3.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -13.1910 1.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -13.3090 3.6690 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -4.6050 -0.8680 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 -4.7360 -2.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -4.4950 -2.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 -5.1750 -3.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3080 -5.3120 -4.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3400 -5.7220 -5.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5850 -5.9960 -4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8040 -5.8620 -3.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7780 -5.4580 -2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 1.7820 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 1.7760 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 1.7640 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 1.1800 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 0.0410 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5910 -2.4180 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 -2.6120 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -4.2800 2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -4.3440 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 -6.3660 3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -8.4550 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -10.9140 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 -10.8230 4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4520 -8.3640 4.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -12.6700 4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -14.2600 3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5030 -4.7970 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -5.0980 -4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -5.8290 -6.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3900 -6.3160 -5.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7780 -6.0770 -2.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9490 -5.3580 -1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 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 38 1 0 0 0 0 6 7 2 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 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 43 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 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 33 2 0 0 0 0 29 30 2 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 31 32 2 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 32 54 1 0 0 0 0 33 55 1 0 0 0 0 M END