CSQ Converted by convert_cif2sdf.py 2024/03/29 11:09:15 61 64 0 0 0 0 0 0 0 0999 V2000 4.6185 4.1506 -1.1528 O 0 0 0 0 0 3.9867 3.4737 -0.0644 C 0 0 0 0 0 3.4553 2.1219 -0.5445 C 0 0 0 0 0 4.5520 1.2599 -0.8914 O 0 0 0 0 0 2.6698 1.4354 0.5898 C 0 0 0 0 0 1.3163 1.2062 0.1935 O 0 0 0 0 0 3.4065 0.0903 0.8012 C 0 0 0 0 0 2.4769 -0.9741 1.0109 O 0 0 0 0 0 4.1559 -0.0852 -0.5495 C 0 0 0 0 0 5.3322 -0.9423 -0.3827 N 0 0 0 0 0 6.3150 -0.5739 0.4597 C 0 0 0 0 0 7.3951 -1.3337 0.6292 N 0 0 0 0 0 7.5294 -2.4784 -0.0292 C 0 0 0 0 0 6.5167 -2.8924 -0.9179 C 0 0 0 0 0 5.4229 -2.1117 -1.0763 C 0 0 0 0 0 6.2155 0.4736 1.0763 O 0 0 0 0 0 8.6495 -3.2545 0.1548 N 0 0 0 0 0 0.0547 1.8038 0.9955 P 0 0 0 0 0 0.1961 3.2720 1.1158 O 0 0 0 0 0 -0.0245 0.9422 2.9309 S 0 0 0 0 0 -1.3006 1.4585 0.1984 O 0 0 0 0 0 -2.5842 1.9415 0.6002 C 0 0 0 0 0 -3.6494 1.4287 -0.3719 C 0 0 0 0 0 -3.8286 0.0042 -0.2152 O 0 0 0 0 0 -5.0270 2.0392 -0.0311 C 0 0 0 0 0 -5.3053 3.1527 -0.8823 O 0 0 0 0 0 -6.0243 0.8901 -0.3000 C 0 0 0 0 0 -6.9483 1.2593 -1.3255 O 0 0 0 0 0 -5.1309 -0.2794 -0.7713 C 0 0 0 0 0 -5.6409 -1.5517 -0.2535 N 0 0 0 0 0 -6.0455 -2.5054 -1.1114 C 0 0 0 0 0 -6.5187 -3.6829 -0.6636 N 0 0 0 0 0 -6.5933 -3.9264 0.6608 C 0 0 0 0 0 -6.1697 -2.9310 1.5747 C 0 0 0 0 0 -5.6944 -1.7600 1.0978 C 0 0 0 0 0 -5.9849 -2.2997 -2.3086 O 0 0 0 0 0 -7.0205 -4.9909 1.0672 O 0 0 0 0 0 4.9796 5.0174 -0.9201 H 0 0 0 0 0 4.7108 3.3159 0.7353 H 0 0 0 0 0 3.1594 4.0777 0.3088 H 0 0 0 0 0 2.8078 2.2649 -1.4100 H 0 0 0 0 0 2.7054 2.0364 1.4975 H 0 0 0 0 0 4.1100 0.1583 1.6308 H 0 0 0 0 0 2.8901 -1.8369 1.1482 H 0 0 0 0 0 3.4870 -0.4925 -1.3065 H 0 0 0 0 0 6.6114 -3.8209 -1.4618 H 0 0 0 0 0 4.6332 -2.4084 -1.7519 H 0 0 0 0 0 9.3448 -2.9667 0.7674 H 0 0 0 0 0 8.7454 -4.0905 -0.3278 H 0 0 0 0 0 -0.1520 -0.3718 2.6722 H 0 0 0 0 0 -2.8088 1.5853 1.6060 H 0 0 0 0 0 -2.5810 3.0317 0.5932 H 0 0 0 0 0 -3.3720 1.6676 -1.3984 H 0 0 0 0 0 -5.0624 2.3415 1.0160 H 0 0 0 0 0 -6.1588 3.5750 -0.7113 H 0 0 0 0 0 -6.5531 0.6218 0.6143 H 0 0 0 0 0 -7.4933 2.0268 -1.1055 H 0 0 0 0 0 -5.0813 -0.3035 -1.8600 H 0 0 0 0 0 -6.2217 -3.1073 2.6385 H 0 0 0 0 0 -5.3635 -0.9906 1.7796 H 0 0 0 0 0 -6.8071 -4.3597 -1.2952 H 0 0 0 0 0 1 2 1 0 0 0 1 38 1 0 0 0 2 3 1 0 0 0 2 39 1 0 0 0 2 40 1 0 0 0 5 3 1 0 0 0 4 3 1 0 0 0 3 41 1 0 0 0 9 4 1 0 0 0 5 7 1 0 0 0 5 6 1 0 0 0 5 42 1 0 0 0 18 6 1 0 0 0 9 7 1 0 0 0 7 8 1 0 0 0 7 43 1 0 0 0 8 44 1 0 0 0 10 9 1 0 0 0 9 45 1 0 0 0 15 10 1 0 0 0 11 10 1 0 0 0 12 11 1 0 0 0 11 16 2 0 0 0 13 12 2 0 0 0 17 13 1 0 0 0 13 14 1 0 0 0 14 15 2 0 0 0 14 46 1 0 0 0 15 47 1 0 0 0 17 48 1 0 0 0 17 49 1 0 0 0 19 18 2 0 0 0 18 20 1 0 0 0 18 21 1 0 0 0 20 50 1 0 0 0 22 21 1 0 0 0 22 23 1 0 0 0 22 51 1 0 0 0 22 52 1 0 0 0 23 25 1 0 0 0 23 24 1 0 0 0 23 53 1 0 0 0 24 29 1 0 0 0 25 26 1 0 0 0 25 27 1 0 0 0 25 54 1 0 0 0 26 55 1 0 0 0 27 29 1 0 0 0 27 28 1 0 0 0 27 56 1 0 0 0 28 57 1 0 0 0 29 30 1 0 0 0 29 58 1 0 0 0 35 30 1 0 0 0 30 31 1 0 0 0 31 32 1 0 0 0 31 36 2 0 0 0 33 32 1 0 0 0 34 33 1 0 0 0 33 37 2 0 0 0 35 34 2 0 0 0 34 59 1 0 0 0 35 60 1 0 0 0 32 61 1 0 0 0 M END $$$$