PUBCHEM-ZINC00923006 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -0.7190 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -0.8520 0.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -2.1330 0.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 0.0140 0.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -1.1090 -1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -2.2390 -2.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 -2.4410 -3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 -1.5140 -4.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 -0.3850 -3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 -0.1850 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 -1.7710 -5.9860 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -0.4890 -6.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -2.6360 -6.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 -2.6200 -5.9780 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 -2.0110 -5.4270 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4370 -1.2450 -4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5100 -1.3840 -6.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1310 -0.1640 -6.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8620 0.4110 -7.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9730 -0.2330 -8.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3510 -1.4520 -8.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6150 -2.0250 -7.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5420 -3.0700 -4.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1820 -2.7870 -3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9430 -3.7570 -2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0670 -5.0140 -3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4250 -5.2960 -4.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6690 -4.3210 -5.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8160 -5.9700 -2.8930 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8980 -7.2420 -3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -0.9020 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -1.6700 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -0.1170 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -2.9630 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -3.3240 -4.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 0.3400 -4.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 0.6960 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 -3.5200 -6.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0450 0.3380 -5.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3480 1.3630 -7.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5450 0.2160 -9.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4370 -1.9550 -9.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1260 -2.9760 -7.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0850 -1.8080 -3.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4420 -3.5360 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5190 -6.2740 -5.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1720 -4.5380 -6.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5240 -7.9100 -2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3340 -7.1180 -4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8990 -7.6670 -3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M END