BVPQ90 -OEChem-04022117103D 62 65 0 1 0 0 0 0 0999 V2000 -2.4205 -2.6914 -0.1736 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2332 -0.9325 -0.7606 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0006 -0.2810 -1.4067 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6743 -3.6334 0.8973 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1862 -3.1124 -1.5398 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7724 -0.8354 0.8438 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1367 0.7338 0.8163 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1192 0.0318 0.3597 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2991 -1.5739 0.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0229 0.5091 2.0216 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9319 -0.9814 -0.1935 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4978 0.7861 2.1115 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3638 -0.5764 0.9728 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4902 -1.5010 -1.5179 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6786 0.2730 0.2664 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0039 -1.6698 -1.4288 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5155 0.0636 3.4143 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7752 1.8016 1.6434 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4755 -0.6650 -0.3412 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6748 -0.3936 -0.9253 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8269 -0.3842 0.4389 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0592 1.8985 -0.0104 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2783 -0.3171 0.1631 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7447 -1.5699 -0.1988 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1121 1.7733 -1.3985 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9305 3.1594 0.5717 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1421 0.7600 0.2216 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0582 -1.8295 -0.5176 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4866 0.5331 -0.0959 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0362 2.9091 -2.2048 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8547 4.2952 -0.2343 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9398 -0.7498 -0.4623 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9075 4.1701 -1.6226 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0549 -1.7715 0.5602 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7206 1.6804 2.7014 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9399 -0.0160 2.7226 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9852 -0.3160 -0.0187 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9309 -1.5336 1.2789 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2644 -0.8053 -2.3366 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0216 -2.4566 -1.7819 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4858 1.1158 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3134 0.5878 1.2512 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4048 -1.9355 -2.4135 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2394 -2.5019 -0.7532 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0729 -0.8970 3.7013 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6044 -0.0464 3.4529 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2387 0.7990 4.1788 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6369 2.0715 0.5927 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4591 2.6441 2.2682 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8558 1.6926 1.7951 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2595 -1.2065 1.6539 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5664 0.4111 -1.6624 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7498 -0.5683 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2873 -0.6998 1.0508 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1974 0.8024 -1.8792 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 3.3282 1.6418 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8205 1.7519 0.5143 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3990 -2.8185 -0.7981 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1941 1.3573 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0744 2.8116 -3.2858 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7625 5.2783 0.2183 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8496 5.0546 -2.2501 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 9 1 0 0 0 0 1 24 1 0 0 0 0 2 32 1 0 0 0 0 3 19 2 0 0 0 0 6 13 1 0 0 0 0 6 19 1 0 0 0 0 6 51 1 0 0 0 0 7 12 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 15 1 0 0 0 0 8 20 1 0 0 0 0 8 54 1 0 0 0 0 9 21 2 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 11 19 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 16 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 20 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 23 1 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 28 1 0 0 0 0 25 30 1 0 0 0 0 25 55 1 0 0 0 0 26 31 2 0 0 0 0 26 56 1 0 0 0 0 27 29 2 0 0 0 0 27 57 1 0 0 0 0 28 32 2 0 0 0 0 28 58 1 0 0 0 0 29 32 1 0 0 0 0 29 59 1 0 0 0 0 30 33 2 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 33 62 1 0 0 0 0 M END $$$$