PUBCHEM-ZINC01202072 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -0.6360 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 -2.6290 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -1.8620 0.0270 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -0.5430 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 0.0650 0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6310 0.2050 0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 1.6240 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6290 -4.0100 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 -4.7170 0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 -6.1210 -0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8650 -4.0790 1.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9170 -4.2880 -1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -5.1000 -2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3870 -4.7670 -3.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1600 -3.6150 -3.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 -2.8020 -2.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 -3.1440 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7870 -3.2750 -5.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5470 -2.1420 -5.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1540 -1.8130 -6.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9940 -2.6930 -7.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3040 -2.7760 -8.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8500 -1.4010 -8.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5090 -1.1460 -9.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0270 0.1120 -10.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8930 1.1230 -9.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2300 0.8830 -7.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6980 -0.3800 -7.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9460 -0.6450 -6.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0050 0.1320 -5.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -2.6190 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 1.9220 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 1.9320 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 2.1020 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -4.5620 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -5.9940 -2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2700 -5.4000 -4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9080 -1.9070 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8090 -2.5150 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6830 -3.8430 -5.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6630 -1.5100 -4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2190 -2.2790 -8.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7010 -3.6930 -7.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1290 -3.2900 -9.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0320 -3.3390 -7.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6190 -1.9290 -10.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5400 0.3070 -10.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3060 2.1010 -9.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1240 1.6710 -7.1670 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 11 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 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 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 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 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 24 25 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 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 M END