B1I9MY -OEChem-04012116562D 40 42 0 0 0 0 0 0 0999 V2000 6.6132 -2.2694 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0823 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.1132 3.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6132 -2.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6132 -2.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1165 2.6785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5812 1.0312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1132 3.2694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 1.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 -1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8042 2.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7472 0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4793 0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7472 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4793 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4223 2.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8532 2.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 -3.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 2.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3733 2.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 2.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 0.7222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 1.3913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0675 2.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2103 0.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0162 0.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2103 -1.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0162 -1.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9932 -3.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 -3.8894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2332 -3.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2389 3.2849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 0.6163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6982 2.7843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5653 0.1157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8759 1.7798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6572 2.1779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2591 2.9591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 11 1 0 0 0 0 1 19 1 0 0 0 0 2 25 1 0 0 0 0 3 8 1 0 0 0 0 3 17 1 0 0 0 0 6 22 1 0 0 0 0 6 26 1 0 0 0 0 7 22 2 0 0 0 0 8 12 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 17 2 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 18 1 0 0 0 0 13 15 1 0 0 0 0 13 27 1 0 0 0 0 14 16 2 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 22 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 23 1 0 0 0 0 20 34 1 0 0 0 0 21 24 2 0 0 0 0 21 35 1 0 0 0 0 23 25 2 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 M END $$$$