B1XA3I -OEChem-04012118082D 45 47 0 1 0 0 0 0 0999 V2000 2.0000 -4.7966 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -5.7966 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -4.7966 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.2634 3.1693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.7423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8621 4.1874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6865 2.5694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 -0.2088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -0.2088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3621 5.0534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 4.3953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 5.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7794 5.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 2.4648 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2688 3.2738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0878 1.5513 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0823 1.4468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 0.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -2.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -2.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -3.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -3.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8637 4.6890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 5.5142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 4.3953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8191 3.7787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1946 6.1610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 6.3335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 5.9795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 5.2609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3166 1.9632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 0.9849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0175 0.8302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6989 1.3820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1471 2.0634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4343 3.1358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3221 2.0678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -1.9866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -1.9866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -3.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -3.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 26 1 0 0 0 0 3 26 1 0 0 0 0 4 15 2 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 15 1 0 0 0 0 14 7 1 6 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 18 2 0 0 0 0 8 19 1 0 0 0 0 9 19 2 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 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 14 35 1 0 0 0 0 16 17 1 6 0 0 0 16 18 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 24 1 0 0 0 0 21 42 1 0 0 0 0 22 25 2 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 M END $$$$