RDKit 3D 47 49 0 0 0 0 0 0 0 0999 V2000 -6.6893 -1.8294 2.4011 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9319 -0.5170 2.3344 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2823 -0.4414 1.0615 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5381 0.6811 0.8832 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4167 1.5797 1.7027 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9271 0.6852 -0.4766 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5718 -0.3596 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0204 0.0219 -2.6154 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6133 1.5105 -2.5520 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6161 2.2366 -1.2116 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2257 1.7072 -2.1988 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2223 1.3655 -3.0809 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4728 0.9668 -4.2163 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1759 1.4859 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4968 0.0159 -1.5043 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9777 0.5680 -0.6826 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8863 -0.2627 -0.1733 N 0 0 0 0 0 2 0 0 0 0 0 0 4.8278 0.5346 0.3743 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4832 1.8395 0.2061 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2965 1.8542 -0.4731 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1326 0.0312 1.1098 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3904 -1.3387 1.2154 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5402 -1.7813 1.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4326 -0.8567 2.4143 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1748 0.5115 2.3117 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0235 0.9563 1.6598 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0545 -0.1844 -3.6488 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8846 -0.3558 -4.4433 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6261 -1.8168 -0.9114 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0065 -2.6784 2.2857 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2176 -1.9264 3.3542 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4184 -1.8931 1.5855 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6331 0.3192 2.4438 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1868 -0.4804 3.1374 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1534 -0.6067 -2.8505 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8004 2.0412 -3.4924 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9865 1.9089 -1.2331 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8927 1.5514 -3.3408 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 2.4121 -1.9338 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6902 -2.0513 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7360 -2.8458 1.9487 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3259 -1.2011 2.9233 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8623 1.2332 2.7408 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8149 2.0204 1.5761 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6701 -2.0027 0.1648 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7239 -2.3250 -1.2733 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4956 -2.2838 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 18 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 8 27 1 0 27 28 3 0 7 29 1 0 10 6 1 0 20 16 2 0 26 21 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 8 35 1 6 9 36 1 6 11 37 1 0 14 38 1 0 14 39 1 0 22 40 1 0 23 41 1 0 24 42 1 0 25 43 1 0 26 44 1 0 29 45 1 0 29 46 1 0 29 47 1 0 M CHG 1 17 -1 M END