PUBCHEM-ZINC04780741 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 0 0 0 0 0 0999 V2000 1.4020 1.4370 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 0.0910 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -0.4240 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -2.0150 0.6980 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -1.9020 -0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -0.7680 -1.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -2.9170 -1.7670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -4.1540 -1.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -4.5590 -0.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -5.0100 -2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -6.4480 -2.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -7.1190 -2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -7.9800 -3.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 -10.0080 -4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2330 -11.0240 -3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4620 -10.3710 -3.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2950 -9.4690 -2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2910 -8.3660 -2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -7.2220 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -8.4390 -2.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -6.4860 -2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -7.2760 -2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8330 -8.4450 -3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 -6.3050 -2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 -7.7920 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 1.3560 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 2.0520 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 1.9520 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 0.0440 2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -2.6670 -2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -4.8010 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -4.7300 -3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -7.7500 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -6.3680 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -7.3630 -4.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -8.5560 -3.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -10.4960 -4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4980 -9.4400 -5.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 -11.7150 -4.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -11.6180 -3.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2710 -9.0240 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 -10.0300 -1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 -7.7760 -3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1200 -7.7200 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -6.1270 -3.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -5.6060 -1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 -8.1010 -4.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 -8.9170 -2.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 -9.2280 -3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 -5.4530 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 -6.8040 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 -5.9080 -3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -8.5500 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -8.2530 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -6.9760 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -8.9950 -3.2330 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6010 -9.5200 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 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 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 56 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 56 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 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END