D02TNR -OEChem-10101305022D 40 41 0 0 0 0 0 0 0999 V2000 5.6736 1.5653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8794 -0.9696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7660 0.3572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.5804 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4465 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -0.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8660 -0.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -1.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8660 -1.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -2.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7057 0.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4718 0.6580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 1.4465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4115 0.3160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2981 1.6428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.4465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1775 0.9587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0642 2.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0039 1.9436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9219 -0.2030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5234 -0.8932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4766 -0.8932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0781 -0.2030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5234 -1.6779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9219 -2.3682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0781 -2.3682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4766 -1.6779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6015 -2.7605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3985 -2.7605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6584 0.9678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 0.0435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5826 1.6585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8923 2.0571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5191 -0.2946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7155 1.8548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7601 0.7467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9565 2.8962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4788 2.3421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 13 2 0 0 0 0 3 6 1 0 0 0 0 3 13 1 0 0 0 0 3 32 1 0 0 0 0 4 12 1 0 0 0 0 4 15 1 0 0 0 0 4 33 1 0 0 0 0 5 18 3 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 13 14 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 15 18 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 19 1 0 0 0 0 16 36 1 0 0 0 0 17 20 2 0 0 0 0 17 37 1 0 0 0 0 19 21 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 M END $$$$