BVCQ30 -OEChem-04012119332D 69 72 0 1 0 0 0 0 0999 V2000 2.9848 -3.2453 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2768 4.0014 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7017 -1.4190 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 -0.4237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.0717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1585 -2.2605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1928 -1.1529 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9696 -3.4190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5011 1.1822 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3470 5.8716 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4348 -0.1826 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5867 0.3473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1953 -1.2227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8207 -0.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8356 -2.9190 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8356 -1.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7017 -3.4190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3620 0.1920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7017 -4.4190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5677 -2.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4283 1.5568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8356 -4.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4337 -3.4190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5677 -4.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5677 -1.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8111 -4.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5675 2.5471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8356 -5.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2997 -2.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5677 -5.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4337 -1.4190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7017 -6.4190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2997 -1.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8482 3.2418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4504 3.0166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2865 4.1406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 5.0235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9027 -0.5894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9684 0.8358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1407 0.7780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5993 -1.3936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -1.8333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 0.2185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2733 -0.5866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8356 -3.5390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7017 -2.7990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9696 -4.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0126 1.5639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5572 0.9504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0479 1.5785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2987 -4.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4337 -4.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1046 -4.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0308 -1.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2005 -4.1224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7034 -4.8407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4217 -4.3378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2987 -6.2290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8367 -3.2290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1046 -6.2290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4337 -0.7990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7017 -7.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8367 -1.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2376 3.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0077 2.7448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3563 5.4384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3285 4.6418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0559 6.4190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9666 5.8499 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 8 1 0 0 0 0 1 26 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 16 2 0 0 0 0 4 18 2 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 7 16 1 0 0 0 0 15 8 1 1 0 0 0 8 47 1 0 0 0 0 9 18 1 0 0 0 0 9 21 1 0 0 0 0 9 48 1 0 0 0 0 10 37 1 0 0 0 0 10 68 1 0 0 0 0 10 69 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 1 0 0 0 11 38 1 0 0 0 0 12 14 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 45 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 17 46 1 0 0 0 0 19 22 2 0 0 0 0 19 24 1 0 0 0 0 20 23 2 0 0 0 0 20 25 1 0 0 0 0 21 27 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 28 1 0 0 0 0 22 51 1 0 0 0 0 23 29 1 0 0 0 0 23 52 1 0 0 0 0 24 30 2 0 0 0 0 24 53 1 0 0 0 0 25 31 2 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 34 1 0 0 0 0 27 35 2 0 0 0 0 28 32 2 0 0 0 0 28 58 1 0 0 0 0 29 33 2 0 0 0 0 29 59 1 0 0 0 0 30 32 1 0 0 0 0 30 60 1 0 0 0 0 31 33 1 0 0 0 0 31 61 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 34 36 2 0 0 0 0 34 64 1 0 0 0 0 35 65 1 0 0 0 0 36 37 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 M END $$$$