PUBCHEM-ZINC06211678 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 0.3050 -2.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -1.9680 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -2.1800 -2.7470 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8970 -2.2610 -2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -2.4570 -3.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -2.5730 -5.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -2.4820 -5.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -2.2870 -3.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -2.6280 -6.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -2.6120 -6.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -2.7990 -7.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -2.7650 -6.3650 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6920 -2.9130 -6.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -2.9930 -8.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -2.3400 -9.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -2.5230 -10.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -3.3590 -11.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 -4.0120 -10.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 -3.8270 -9.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 -4.8280 -11.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0950 -5.4660 -10.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -3.5380 -12.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1310 -2.6350 -13.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -1.8860 -11.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -1.0440 -10.9060 C 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -2.4160 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -2.4330 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -2.1700 -1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6960 -2.5210 -3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -2.2190 -3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 -3.9670 -6.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 -2.5330 -7.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3560 -2.3500 -6.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.6920 -8.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 -4.3300 -8.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7790 -6.0870 -10.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6620 -4.7090 -9.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 -6.0900 -9.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -1.6160 -13.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -2.7140 -13.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 -2.8880 -14.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -1.6360 -10.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.2550 -10.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -0.5990 -11.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 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 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 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 48 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 M CHG 1 8 1 M CHG 1 17 1 M END