B2F9CA -OEChem-04012118082D 48 50 0 1 0 0 0 0 0999 V2000 4.2634 -4.7966 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5313 -1.7966 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.1693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7634 0.7423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2634 -4.7966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2634 -4.7966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 4.1874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5768 2.5694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4543 -0.2088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0724 -0.2088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3794 4.3953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9013 5.0534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4839 5.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5704 5.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 2.4648 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9945 3.2738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1756 1.5513 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1810 1.4468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 0.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -0.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -1.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -3.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3973 -2.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1294 -2.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3973 -3.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1294 -3.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -5.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4442 3.7787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9994 4.3953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4864 5.5142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3997 4.6890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0904 5.2609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6755 5.9795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8804 6.3335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0688 6.1610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8345 3.0312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9234 0.9849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1162 2.0634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5644 1.3820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2459 0.8302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 3.1358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9413 2.0678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6663 -1.9866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8604 -3.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6663 -3.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6434 -5.7966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -6.4166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8834 -5.7966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 1 27 1 0 0 0 0 2 23 1 0 0 0 0 3 16 2 0 0 0 0 4 10 1 0 0 0 0 4 19 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 7 16 1 0 0 0 0 15 8 1 1 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 19 2 0 0 0 0 9 20 1 0 0 0 0 10 20 2 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 17 18 1 1 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 20 21 1 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 23 25 1 0 0 0 0 24 26 2 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END $$$$