PUBCHEM-ZINC04489429 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 75 0 0 1 0 0 0 0 0999 V2000 0.0120 1.4240 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -0.0980 0.2990 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8210 -0.7220 1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -2.2520 1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -2.8250 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -2.2340 0.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3390 -0.6960 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -2.5780 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -2.0010 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -2.6070 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.4690 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -1.9840 -2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 -2.4300 -3.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 -1.5710 -5.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -1.9910 -6.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 -3.2870 -6.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 -4.1550 -5.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 -3.7270 -4.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 -5.7610 -5.5830 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 -3.7530 -7.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0030 -3.1630 -8.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8190 -4.1530 -8.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 -5.2230 -9.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1070 -3.7000 -9.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1290 -4.4390 -9.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6720 -4.6700 -11.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4130 -3.5870 -10.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4540 -5.7810 -9.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7960 -1.2270 -7.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 0.0800 -7.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -2.8110 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 1.8650 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 1.8820 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7050 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -0.3100 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -0.4650 2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -2.6770 2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 -3.9190 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -2.5980 2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -0.4280 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -0.2590 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -3.6680 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -2.1760 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 -2.2200 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -3.6970 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -0.0320 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -0.0280 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 -2.4430 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -0.8960 -2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -0.5720 -4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 -4.4110 -3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7940 -2.2950 -8.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6180 -2.8480 -7.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3760 -2.7940 -8.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4030 -3.7240 -11.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4640 -5.1400 -12.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7950 -5.3240 -11.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7780 -3.3920 -9.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2140 -4.0870 -10.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2310 -2.6150 -10.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5950 -6.4600 -9.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2760 -6.2930 -9.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7470 -5.6330 -8.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 0.0460 -7.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 0.7090 -6.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 0.5310 -8.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 -2.5750 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -2.4040 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -3.9020 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -2.3810 -2.4210 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5730 -3.4030 -2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -2.0080 -3.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 31 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 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 70 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 12 70 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 51 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 31 69 1 0 0 0 0 70 71 1 0 0 0 0 70 72 1 0 0 0 0 M CHG 1 70 1 M END