IFLAB-ZINC04315391 MOE2007 3D Structure written by MMmdl. 45 48 0 0 1 0 0 0 0 0999 V2000 -1.2300 2.2980 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 3.6930 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 4.2880 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 3.4120 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 2.0340 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 1.4270 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 1.5040 -0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 0.5090 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 2.4770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 2.3120 -0.0650 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1780 3.2910 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3380 1.2520 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8550 1.1310 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3120 0.8610 -0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2710 2.0490 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2770 1.7940 -2.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7220 2.1800 -3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7090 1.2030 -3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0520 1.5680 -3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4230 2.9100 -3.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4480 3.8850 -3.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1040 3.5300 -3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9000 5.5430 -3.1060 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 1.8860 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 4.3250 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 5.3570 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 0.3560 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 1.5020 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 0.2790 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 0.3230 1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3190 2.0560 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9370 -0.0990 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4040 0.8790 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 1.1140 -1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9760 2.8750 -2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 0.7600 -3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6640 2.4490 -3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4480 0.1480 -3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8110 0.8050 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4700 3.1850 -3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3600 4.3110 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 3.6320 0.1240 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0660 4.5490 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7770 1.9470 -1.5420 N 0 3 0 0 0 0 0 0 0 0 0 0 7.1700 2.8370 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 42 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 44 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 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 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 42 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 42 1 M CHG 1 44 1 M END