BE4J2F -OEChem-04012120082D 42 45 0 1 0 0 0 0 0999 V2000 6.6073 2.9517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0011 2.1470 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.4799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 -0.0201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -3.0201 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.0201 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6660 -1.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.5201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.5201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -2.5201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.9799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.5201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.9854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -3.0548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5960 3.0548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -3.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 1.9799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.5999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -1.2101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9951 1.7899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.6401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 0.1699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.3655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -3.6747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1856 3.2465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4673 3.6612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.1872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0881 -3.5570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -3.3301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7081 -2.4832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.8530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 2.5168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 2.2899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 1.4430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 22 1 0 0 0 0 2 17 1 0 0 0 0 2 22 1 0 0 0 0 3 14 1 0 0 0 0 3 25 1 0 0 0 0 4 14 2 0 0 0 0 5 12 1 0 0 0 0 5 16 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 6 26 1 0 0 0 0 7 9 1 0 0 0 0 7 10 2 0 0 0 0 8 11 2 0 0 0 0 8 13 1 0 0 0 0 9 12 1 0 0 0 0 9 18 2 0 0 0 0 10 16 1 0 0 0 0 10 27 1 0 0 0 0 11 15 1 0 0 0 0 11 28 1 0 0 0 0 12 20 2 0 0 0 0 13 19 2 0 0 0 0 13 29 1 0 0 0 0 15 17 2 0 0 0 0 16 23 1 0 0 0 0 17 19 1 0 0 0 0 18 21 1 0 0 0 0 18 31 1 0 0 0 0 19 30 1 0 0 0 0 20 24 1 0 0 0 0 20 32 1 0 0 0 0 21 24 2 0 0 0 0 21 35 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END $$$$