B7GOV6 -OEChem-04012120362D 39 40 0 1 0 0 0 0 0999 V2000 6.3301 -0.6956 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.8044 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 5.8301 -1.5616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 -1.5616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9101 1.5171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.8044 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.4641 2.8044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.8044 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3549 -2.5822 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.1956 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2044 -0.1997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2044 0.8086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.3044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9101 -0.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.3044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.3044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6493 -1.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6828 -2.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.3044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4220 -3.0959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0941 -3.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1277 -3.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3554 -0.7948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.0879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -0.7782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5093 -0.7490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.9244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2453 -1.6912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.9244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8228 -3.2551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5316 -3.9869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9660 -4.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.1144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 5 13 2 0 0 0 0 6 18 1 0 0 0 0 7 18 2 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 19 1 0 0 0 0 9 24 2 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 13 1 0 0 0 0 11 16 2 0 0 0 0 12 15 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 17 1 0 0 0 0 16 19 1 0 0 0 0 16 30 1 0 0 0 0 17 20 2 0 0 0 0 17 31 1 0 0 0 0 19 21 2 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 21 23 1 0 0 0 0 21 33 1 0 0 0 0 22 26 2 0 0 0 0 22 34 1 0 0 0 0 23 25 2 0 0 0 0 23 35 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 25 37 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 M CHG 2 2 1 6 -1 M END $$$$