PUBCHEM-ZINC02972665 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -1.0160 1.9020 -2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 0.5470 -2.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -0.2170 -1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 0.2160 -1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7010 -0.6440 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 -1.9410 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -2.3830 -0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -1.5230 -1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -1.8810 -1.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -2.9980 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3940 -3.0360 0.3230 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 -4.2200 0.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 -2.2440 1.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 -3.4540 -0.9580 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1430 -4.7070 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7240 -4.6580 -3.1550 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2590 -5.4590 -3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2200 -4.9040 -3.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7410 -6.1450 -3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1130 -6.3770 -3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9300 -5.3560 -3.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4730 -4.1470 -2.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1390 -3.9520 -2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0380 -3.0460 -5.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 -1.7330 -5.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 -1.7890 -6.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 -1.9970 -4.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 -3.3300 -4.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 2.3660 -3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 1.9670 -3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 2.4550 -1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2000 1.2170 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6860 -0.2920 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -3.3950 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -2.9020 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -3.9320 -1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -3.0260 -1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4140 -3.3700 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 -4.8470 -1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5550 -5.5580 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0900 -6.9460 -3.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5320 -7.3330 -3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0060 -5.4870 -2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8360 -2.9570 -2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1020 -2.9590 -4.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8550 -3.8910 -5.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0410 -1.5490 -6.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 -0.8840 -5.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -2.0010 -5.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 -1.1590 -4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5910 -4.1660 -4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 -3.4770 -3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -3.3480 -3.8490 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.4630 -2.6020 -3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 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 16 18 1 0 0 0 0 16 53 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END