BV69QB -OEChem-04022103063D 45 48 0 0 0 0 0 0 0999 V2000 -5.3339 1.2968 1.2258 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6448 -0.8383 -1.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 2.0466 -0.6965 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4348 1.5643 -2.3678 O 0 5 0 0 0 0 0 0 0 0 0 0 5.8874 2.4141 -0.3949 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0229 -3.6769 1.4346 O 0 5 0 0 0 0 0 0 0 0 0 0 5.9892 -3.0291 0.7045 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 1.0029 0.1061 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8026 2.1530 1.3642 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1693 0.8975 -0.2601 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 1.5752 -1.1210 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7666 -2.8220 0.8958 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5998 -1.7409 -1.2926 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5319 -0.5575 -0.3724 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9251 -2.5065 -1.1553 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1276 -1.5557 -1.1007 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0442 -0.6108 0.1068 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6629 -0.0490 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 0.2104 -0.0281 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6702 1.2460 0.8409 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9925 0.0450 -0.4618 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5653 2.0049 0.9833 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5403 2.9727 1.5218 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8651 0.1348 0.5188 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3007 -0.1103 0.2938 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1081 0.8555 -0.3074 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8504 -1.3286 0.6926 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4649 0.6028 -0.5098 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2072 -1.5814 0.4902 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0144 -0.6155 -0.1109 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4924 -1.3848 -2.3246 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7711 -2.4292 -1.0934 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0339 -3.2015 -1.9956 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9055 -3.1119 -0.2399 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0590 -2.1309 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1627 -0.9679 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2906 -1.1665 1.0201 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7861 0.1880 -0.0054 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1789 2.4374 2.1477 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0226 3.7482 2.1236 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0068 3.4485 0.6945 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4002 -0.4093 1.3626 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2022 -2.0680 1.1579 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0752 -0.7920 -0.2782 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6487 2.1265 -0.3939 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 20 1 0 0 0 0 2 21 2 0 0 0 0 3 26 1 0 0 0 0 3 45 1 0 0 0 0 4 11 1 0 0 0 0 5 11 2 0 0 0 0 6 12 1 0 0 0 0 7 12 2 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 20 1 0 0 0 0 9 22 2 0 0 0 0 10 24 2 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 2 0 0 0 0 27 43 1 0 0 0 0 28 30 2 0 0 0 0 29 30 1 0 0 0 0 30 44 1 0 0 0 0 M CHG 4 4 -1 6 -1 11 1 12 1 M END $$$$