IBS-ZINC02373013 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0150 1.4750 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.0320 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -0.7350 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.1180 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.8040 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.1000 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.7070 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.8320 -2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -4.1740 -2.6340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -4.3730 -3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -3.1700 -4.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -2.3000 -3.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -5.7070 -4.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -6.1820 -4.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -7.5160 -5.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -8.0350 -5.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 -8.1320 -5.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -9.3220 -6.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -10.2400 -6.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -11.4140 -7.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -11.6750 -8.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -10.7630 -8.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -9.5900 -7.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6420 -11.0460 -9.1730 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6340 -12.0820 -9.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5450 -10.2430 -9.3260 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0070 1.8550 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8400 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.8210 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -0.2020 2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -2.6620 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -3.8830 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.1570 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -5.6060 -5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -6.4340 -4.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -6.2830 -3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 -5.4550 -5.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 -7.7500 -5.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -10.0370 -5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -12.1280 -7.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -12.5930 -8.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 -8.8800 -7.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END