PUBCHEM-ZINC05851734 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 -0.3350 0.0110 -4.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -1.3040 -3.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -1.5700 -3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -0.5230 -2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 0.7950 -2.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 1.0600 -3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 -0.8150 -1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -1.0790 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 -1.2860 -1.9490 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8870 -0.4020 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 -1.4380 -3.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8460 -2.5710 -3.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8040 -2.7360 -0.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7350 -2.7190 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8930 -1.6810 0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1440 -1.8650 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8420 -1.6990 3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0630 -2.9600 4.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 -4.1270 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9940 -4.2310 1.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2210 -5.2140 -0.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9120 -5.2210 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8710 -6.6750 -1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9910 -7.4290 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2040 -6.5680 0.3920 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1530 -6.8800 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8460 -6.7680 1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2650 -5.7220 2.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 0.2170 -4.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -2.1230 -4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -2.6000 -2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 1.6210 -2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 2.0840 -3.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 0.0310 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -1.6750 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 -1.9500 -3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -0.2310 -3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9440 -0.6700 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 -1.7130 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6450 -2.8200 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8710 -1.0960 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5060 -0.9230 3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8230 -1.3300 3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1120 -3.2730 4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7690 -2.7840 5.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4290 -4.5710 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9380 -4.8800 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9050 -6.9020 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6640 -6.9260 -2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5930 -8.4470 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0490 -7.5050 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5160 -0.4120 -3.2210 O 0 5 0 0 0 0 0 0 0 0 0 0 5.6260 -2.5260 -1.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 -3.2860 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2670 -4.0870 3.5920 N 0 3 0 0 0 0 0 0 0 0 0 0 6.8430 -4.6770 4.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8840 -4.8080 3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5520 -3.9230 2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8400 -7.9540 2.2240 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 53 1 0 0 0 0 11 12 2 0 0 0 0 11 52 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 13 53 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 55 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 59 1 0 0 0 0 53 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 M CHG 1 52 -1 M CHG 1 55 1 M CHG 1 59 -1 M END