PUBCHEM-ZINC05930319 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 1.7950 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 2.2560 -2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 2.4880 -3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 2.2560 -3.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 1.8230 -2.3220 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6970 2.9880 -4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 3.1460 -5.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 3.6650 -7.2020 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 4.9640 -7.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2590 2.4980 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9690 4.1540 -1.8350 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4590 3.6030 -2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5460 3.7130 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2060 5.6310 -2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2920 6.4100 -1.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5830 6.1350 -2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5500 7.6590 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9480 8.1710 -2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9140 9.6940 -2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3130 10.2060 -3.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2800 11.7070 -3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2440 12.3060 -3.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 1.5530 -0.0090 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 2.4340 -4.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 2.2690 -5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 3.9480 -4.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 2.3300 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 1.8120 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3740 2.6450 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 4.2640 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6160 3.9150 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9040 5.6940 -3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2820 5.8540 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2290 8.0990 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8510 7.9390 -3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2690 7.7300 -3.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6470 7.8900 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5940 10.1350 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2160 9.9750 -3.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6330 9.7660 -4.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0120 9.9260 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 1.6720 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 3.8450 -8.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 2.5900 -7.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 3.8820 -1.8630 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 4.0820 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4010 12.3790 -3.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3300 13.3400 -3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 1.7130 -8.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 4.1560 -8.9580 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 50 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 48 55 1 0 0 0 0 49 54 1 0 0 0 0 50 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 7 1 M CHG 1 25 -1 M END