JRB Converted by convert_cif2sdf.py 2024/03/29 11:09:15 28 29 0 0 0 0 0 0 0 0999 V2000 0.8721 -0.3827 1.1922 C 0 0 0 0 0 2.3521 0.0046 1.2125 C 0 0 0 0 0 2.9922 -0.4513 -0.0305 N 0 0 0 0 0 2.3462 0.1522 -1.2032 C 0 0 0 0 0 0.8652 -0.2351 -1.2236 C 0 0 0 0 0 0.2261 0.2208 0.0184 N 0 0 0 0 0 -1.1476 -0.0526 0.0059 C 0 0 0 0 0 -1.5951 -1.3646 -0.0342 C 0 0 0 0 0 -2.9517 -1.6314 -0.0476 C 0 0 0 0 0 -3.8651 -0.5941 -0.0211 C 0 0 0 0 0 -3.4277 0.7161 0.0180 C 0 0 0 0 0 -2.0688 0.9938 0.0376 C 0 0 0 0 0 -1.6241 2.3208 0.0838 N 0 0 0 0 0 0.7802 -1.4677 1.1396 H 0 0 0 0 0 0.3886 -0.0210 2.1001 H 0 0 0 0 0 2.4440 1.0873 1.2921 H 0 0 0 0 0 2.8402 -0.4659 2.0657 H 0 0 0 0 0 3.9813 -0.2542 -0.0201 H 0 0 0 0 0 2.4371 1.2372 -1.1507 H 0 0 0 0 0 2.8287 -0.2095 -2.1112 H 0 0 0 0 0 0.3781 0.2354 -2.0778 H 0 0 0 0 0 0.7743 -1.3178 -1.3031 H 0 0 0 0 0 -0.8842 -2.1769 -0.0554 H 0 0 0 0 0 -3.2983 -2.6544 -0.0783 H 0 0 0 0 0 -4.9236 -0.8088 -0.0315 H 0 0 0 0 0 -4.1436 1.5245 0.0382 H 0 0 0 0 0 -0.6730 2.5127 0.0931 H 0 0 0 0 0 -2.2656 3.0476 0.1062 H 0 0 0 0 0 1 2 1 0 0 0 1 6 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 7 12 2 0 0 0 8 9 2 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 12 13 1 0 0 0 1 14 1 0 0 0 1 15 1 0 0 0 2 16 1 0 0 0 2 17 1 0 0 0 3 18 1 0 0 0 4 19 1 0 0 0 4 20 1 0 0 0 5 21 1 0 0 0 5 22 1 0 0 0 8 23 1 0 0 0 9 24 1 0 0 0 10 25 1 0 0 0 11 26 1 0 0 0 13 27 1 0 0 0 13 28 1 0 0 0 M END $$$$