CHEMDIV-ZINC06948291 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 0.2500 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -1.8540 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -2.8850 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -4.2230 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 -3.8330 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9050 -2.4500 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 -1.8510 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 -2.6270 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 -4.0060 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -4.6070 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6650 -4.9960 0.0620 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2870 -6.2580 0.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6900 -4.1900 0.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0940 -5.2620 -1.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2170 -6.0430 -2.3900 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6050 -6.7140 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0660 -6.8640 -3.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8700 -7.8800 -2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1300 -7.5560 -2.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8670 -8.4890 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3430 -9.7460 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0830 -10.0700 -1.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3480 -9.1390 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3230 -5.1110 -3.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4100 -3.9170 -3.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -2.7950 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.8040 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -4.7920 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -4.8010 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2490 -0.7740 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2760 -2.1570 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 -5.6840 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9260 -4.9010 -1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7420 -6.2010 -3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4150 -7.3760 -4.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5390 -6.5750 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8520 -8.2360 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9190 -10.4740 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6740 -11.0520 -1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3650 -9.3930 -2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4310 -5.6070 -4.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -4.9700 -4.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 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 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 27 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 49 50 1 0 0 0 0 M END