BV5K3Q -OEChem-04022108033D 46 47 0 1 0 0 0 0 0999 V2000 5.1719 1.8029 -0.1202 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2338 1.4515 -1.3273 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0504 2.4326 0.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7025 -2.2523 0.1309 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7183 -0.4093 -0.3826 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0126 0.3244 0.7656 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8375 -1.7930 -0.6611 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7413 -2.6294 -0.8339 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5699 -3.3950 -1.0015 N 0 5 0 0 0 0 0 0 0 0 0 0 3.3774 0.7835 0.9821 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1614 -0.4656 1.3744 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3919 -1.6140 0.7242 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9446 -1.1388 0.7384 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8891 1.3759 -0.2968 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9452 1.2066 0.7508 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 0.6135 0.6996 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 1.3036 0.0943 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7872 2.3931 -1.2696 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7781 0.8515 -0.0308 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0888 -0.5009 0.1106 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7897 1.7762 -0.2897 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4114 -0.9287 -0.0066 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1122 1.3484 -0.4071 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4231 -0.0040 -0.2656 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6114 -3.1321 0.3944 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6916 0.5992 -0.6478 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3904 1.5586 1.7563 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2188 -0.4418 1.0931 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1096 -0.5838 2.4644 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4974 -2.5505 1.2854 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3557 -1.4742 -0.1211 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4457 -1.4584 1.6602 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5579 -0.3477 1.1715 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1743 2.2752 -0.3495 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8027 2.6914 -0.9961 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2317 3.2826 -1.5819 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8423 1.6652 -2.0846 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2813 -1.2008 0.2827 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 2.8342 -0.4011 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8451 2.1221 -0.6084 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0273 -4.1413 0.4824 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1295 -2.9051 1.3517 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9006 -3.1556 -0.4387 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6643 0.1000 -0.7093 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5199 1.0811 -1.6163 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7571 1.3225 0.1722 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 18 1 0 0 0 0 2 14 2 0 0 0 0 3 15 2 0 0 0 0 4 22 1 0 0 0 0 4 25 1 0 0 0 0 5 24 1 0 0 0 0 5 26 1 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 6 15 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 19 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 38 1 0 0 0 0 21 23 2 0 0 0 0 21 39 1 0 0 0 0 22 24 2 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M CHG 2 8 1 9 -1 M END $$$$