COMGENEX-ZINC04188438 MOE2007 3D Structure written by MMmdl. 47 50 0 0 0 0 0 0 0 0999 V2000 4.1300 3.6470 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 3.7670 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 4.0890 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.1510 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 1.7460 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 1.0500 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 1.7310 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 3.1290 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 3.8550 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 5.2500 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 5.3710 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 6.6250 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 7.7740 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 7.6890 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 6.4240 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 8.9350 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 10.6020 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 10.9960 -2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 11.8640 -3.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 12.2010 -4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 11.6710 -5.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 10.8030 -4.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 10.4630 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 4.5840 -1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1970 3.4060 -1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 2.8580 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 4.5450 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 2.8320 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 1.2020 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.0380 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 1.1720 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 3.6480 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 6.7140 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 8.7430 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 6.3290 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 8.7660 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 9.7590 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 10.3830 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 11.4030 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 12.2940 -2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 12.8800 -5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 11.9360 -6.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3790 10.3910 -5.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 9.7830 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 9.3820 -1.2770 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5440 8.6160 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 9.5510 -1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 45 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 M CHG 1 45 1 M END