BO3GS5 -OEChem-04022107022D 64 68 0 0 0 0 0 0 0999 V2000 3.4030 3.6651 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 19.7270 -3.5311 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.4541 3.4203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4541 -0.0902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 3.6651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2270 -0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.1651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7270 -3.5311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 3.1651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7270 -3.5311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 4.5311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 2.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7270 -4.5311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7270 -2.5311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7270 1.6651 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.1651 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7270 -0.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 1.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1434 2.4698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1434 0.8603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7270 1.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2270 0.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2270 2.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2270 0.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2270 2.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7270 1.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7270 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2270 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2270 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7270 -1.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7270 -1.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2270 -2.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2270 -2.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 3.2851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.0451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.8551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9170 0.2621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9170 3.0680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5370 3.0680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3470 1.6651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.5451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0370 0.4699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.5451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 3.9751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5370 -0.3961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1070 -1.7990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.3551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.7851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3470 -1.7990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9170 -3.2020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.4751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0370 -4.0680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 9 1 0 0 0 0 1 11 2 0 0 0 0 1 12 2 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 2 13 2 0 0 0 0 2 14 2 0 0 0 0 3 20 2 0 0 0 0 4 21 2 0 0 0 0 5 30 2 0 0 0 0 6 33 2 0 0 0 0 7 42 1 0 0 0 0 8 45 1 0 0 0 0 9 63 1 0 0 0 0 10 64 1 0 0 0 0 15 20 1 0 0 0 0 15 21 1 0 0 0 0 15 22 1 0 0 0 0 16 30 1 0 0 0 0 16 34 1 0 0 0 0 16 53 1 0 0 0 0 17 33 1 0 0 0 0 17 35 1 0 0 0 0 17 54 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 22 27 1 0 0 0 0 22 28 2 0 0 0 0 23 25 2 0 0 0 0 23 46 1 0 0 0 0 24 26 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 48 1 0 0 0 0 27 29 2 0 0 0 0 27 49 1 0 0 0 0 28 31 1 0 0 0 0 28 50 1 0 0 0 0 29 32 1 0 0 0 0 29 33 1 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 34 36 2 0 0 0 0 34 37 1 0 0 0 0 35 38 2 0 0 0 0 35 39 1 0 0 0 0 36 40 1 0 0 0 0 36 55 1 0 0 0 0 37 41 2 0 0 0 0 37 56 1 0 0 0 0 38 43 1 0 0 0 0 38 57 1 0 0 0 0 39 44 2 0 0 0 0 39 58 1 0 0 0 0 40 42 2 0 0 0 0 40 59 1 0 0 0 0 41 42 1 0 0 0 0 41 60 1 0 0 0 0 43 45 2 0 0 0 0 43 61 1 0 0 0 0 44 45 1 0 0 0 0 44 62 1 0 0 0 0 M END $$$$