BN7GV4 -OEChem-04012115223D 33 35 0 1 0 0 0 0 0999 V2000 -3.2289 1.3985 -0.1251 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4559 -0.4474 -0.9553 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2347 2.2369 1.0999 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4393 2.3997 -0.4808 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5298 -2.2255 -0.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9173 2.2257 -1.0984 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1441 1.8195 1.2615 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8243 -2.4600 0.2751 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2198 -0.5011 -0.1634 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6447 1.1062 -0.7006 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9521 -2.3147 0.3796 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -0.1701 -0.1663 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3785 0.3492 -0.4263 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9317 1.0426 0.8094 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3726 1.2800 0.4023 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7015 0.0142 -0.3828 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2684 -1.0958 0.4912 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0941 -0.1609 -0.2746 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2557 -1.8099 0.2368 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8068 -1.2850 0.0632 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2418 -1.4020 0.0777 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0835 1.0635 -1.2042 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 0.3874 1.6881 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 1.4806 1.2484 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3783 0.2090 -1.2225 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5666 -1.4043 1.2723 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2058 -0.7862 0.9625 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1793 -2.3446 0.4111 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3125 1.9992 1.2951 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3664 2.4947 -0.7588 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9853 1.8928 -0.7359 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9599 -0.2050 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6905 -2.4884 -0.7379 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 2 13 1 0 0 0 0 2 16 1 0 0 0 0 3 14 1 0 0 0 0 3 29 1 0 0 0 0 4 15 1 0 0 0 0 4 30 1 0 0 0 0 5 17 1 0 0 0 0 5 33 1 0 0 0 0 8 21 2 0 0 0 0 9 13 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 10 18 1 0 0 0 0 10 31 1 0 0 0 0 11 19 2 0 0 0 0 11 20 1 0 0 0 0 12 21 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 18 20 2 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 M END $$$$