J6Q Converted by convert_cif2sdf.py 2024/03/29 11:09:15 39 41 0 0 0 0 0 0 0 0999 V2000 3.8838 -2.3326 -0.8808 C 0 0 0 0 0 2.9431 -1.4939 -0.0542 C 0 0 0 0 0 2.0954 -0.5940 -0.6726 C 0 0 0 0 0 1.2164 0.0445 1.4614 C 0 0 0 0 0 2.0588 -0.8589 2.0797 C 0 0 0 0 0 2.9235 -1.6287 1.3223 C 0 0 0 0 0 0.4627 2.5315 0.0629 C 0 0 0 0 0 1.8525 3.0548 -0.1888 C 0 0 0 0 0 -1.1159 0.6879 -0.4442 C 0 0 0 0 0 -1.7154 0.6915 0.8089 C 0 0 0 0 0 -3.1287 -0.1684 -1.4171 C 0 0 0 0 0 -1.8038 0.2688 -1.5450 C 0 0 0 0 0 1.2325 0.1747 0.0854 C 0 0 0 0 0 3.9834 -2.7643 2.0983 CL 0 0 0 0 0 0.3085 1.1564 -0.5891 C 0 0 0 0 0 2.6401 2.3955 -0.8245 O 0 0 0 0 0 2.2162 4.2538 0.2930 O 0 0 0 0 0 -3.0182 0.2725 0.9605 C 0 0 0 0 0 -3.7368 -0.1585 -0.1492 C 0 0 0 0 0 -5.0151 -0.6262 -0.3354 N 0 0 0 0 0 -6.0424 -0.8045 0.6933 C 0 0 0 0 0 -5.1439 -0.8986 -1.7059 N 0 0 0 0 0 -4.0382 -0.6205 -2.3031 N 0 0 0 0 0 3.3907 -3.2630 -1.1616 H 0 0 0 0 0 4.1645 -1.7842 -1.7796 H 0 0 0 0 0 4.7780 -2.5567 -0.2984 H 0 0 0 0 0 2.1081 -0.4923 -1.7472 H 0 0 0 0 0 0.5404 0.6444 2.0528 H 0 0 0 0 0 2.0427 -0.9643 3.1546 H 0 0 0 0 0 0.2960 2.4451 1.1368 H 0 0 0 0 0 -0.2678 3.2202 -0.3634 H 0 0 0 0 0 -1.1556 1.0264 1.6703 H 0 0 0 0 0 -1.3282 0.2754 -2.5138 H 0 0 0 0 0 0.5617 1.2264 -1.6468 H 0 0 0 0 0 3.1186 4.5467 0.1068 H 0 0 0 0 0 -3.4807 0.2814 1.9362 H 0 0 0 0 0 -6.6250 0.1119 0.7876 H 0 0 0 0 0 -6.7011 -1.6258 0.4113 H 0 0 0 0 0 -5.5666 -1.0321 1.6467 H 0 0 0 0 0 16 8 2 0 0 0 21 20 1 0 0 0 17 8 1 0 0 0 8 7 1 0 0 0 18 19 2 0 0 0 18 10 1 0 0 0 20 19 1 0 0 0 20 22 1 0 0 0 19 11 1 0 0 0 10 9 2 0 0 0 22 23 2 0 0 0 11 23 1 0 0 0 11 12 2 0 0 0 7 15 1 0 0 0 9 12 1 0 0 0 9 15 1 0 0 0 15 13 1 0 0 0 13 3 2 0 0 0 13 4 1 0 0 0 3 2 1 0 0 0 4 5 2 0 0 0 2 1 1 0 0 0 2 6 2 0 0 0 5 6 1 0 0 0 6 14 1 0 0 0 1 24 1 0 0 0 1 25 1 0 0 0 1 26 1 0 0 0 3 27 1 0 0 0 4 28 1 0 0 0 5 29 1 0 0 0 7 30 1 0 0 0 7 31 1 0 0 0 10 32 1 0 0 0 12 33 1 0 0 0 15 34 1 0 0 0 17 35 1 0 0 0 18 36 1 0 0 0 21 37 1 0 0 0 21 38 1 0 0 0 21 39 1 0 0 0 M END $$$$