JR4 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 43 45 0 0 0 0 0 0 0 0999 V2000 -5.1688 -1.6799 -1.3032 C 0 0 0 0 0 -4.9140 0.8012 -1.0836 C 0 0 0 0 0 -4.1620 3.1338 -0.5756 C 0 0 0 0 0 -3.0045 0.9531 0.0404 C 0 0 0 0 0 -1.8559 1.3224 0.7234 C 0 0 0 0 0 -0.9962 0.3513 1.1994 C 0 0 0 0 0 -1.2770 -0.9894 0.9962 C 0 0 0 0 0 -0.3319 -2.0402 1.5194 C 0 0 0 0 0 -2.4187 -1.3670 0.3173 C 0 0 0 0 0 -3.2867 -0.3995 -0.1646 C 0 0 0 0 0 1.9987 0.9201 -0.1574 C 0 0 0 0 0 3.4076 0.6121 -0.5953 C 0 0 0 0 0 4.4377 1.4723 -0.2642 C 0 0 0 0 0 5.7302 1.1879 -0.6612 C 0 0 0 0 0 5.9936 0.0412 -1.3896 C 0 0 0 0 0 4.9614 -0.8208 -1.7201 C 0 0 0 0 0 3.6690 -0.5343 -1.3227 C 0 0 0 0 0 7.2574 -0.2383 -1.7786 F 0 0 0 0 0 -4.4874 -0.4573 -0.8688 N 0 0 0 0 0 -4.0413 1.6741 -0.5474 N 0 0 0 0 0 1.7549 0.3239 1.1586 N 0 0 0 0 0 -5.9330 1.1033 -1.6764 O 0 0 0 0 0 0.4931 2.2418 2.0627 O 0 0 0 0 0 0.4877 0.0461 3.2580 O 0 0 0 0 0 0.4630 0.8207 2.0676 S 0 0 0 0 0 -6.0840 -1.4179 -1.8323 H 0 0 0 0 0 -4.5134 -2.2444 -1.9670 H 0 0 0 0 0 -5.4136 -2.2875 -0.4325 H 0 0 0 0 0 -5.0747 3.4130 -1.1023 H 0 0 0 0 0 -4.1999 3.5151 0.4454 H 0 0 0 0 0 -3.3007 3.5592 -1.0893 H 0 0 0 0 0 -1.6343 2.3675 0.8826 H 0 0 0 0 0 -0.5604 -2.2455 2.5658 H 0 0 0 0 0 -0.4464 -2.9535 0.9361 H 0 0 0 0 0 0.6932 -1.6813 1.4350 H 0 0 0 0 0 -2.6342 -2.4134 0.1614 H 0 0 0 0 0 1.8652 1.9999 -0.0968 H 0 0 0 0 0 1.2952 0.5066 -0.8793 H 0 0 0 0 0 4.2311 2.3679 0.3035 H 0 0 0 0 0 6.5348 1.8615 -0.4028 H 0 0 0 0 0 5.1660 -1.7157 -2.2890 H 0 0 0 0 0 2.8645 -1.2077 -1.5769 H 0 0 0 0 0 2.3506 -0.3634 1.4972 H 0 0 0 0 0 14 13 2 0 0 0 14 15 1 0 0 0 18 15 1 0 0 0 13 12 1 0 0 0 15 16 2 0 0 0 12 17 2 0 0 0 12 11 1 0 0 0 16 17 1 0 0 0 11 21 1 0 0 0 3 20 1 0 0 0 21 25 1 0 0 0 20 2 1 0 0 0 20 4 1 0 0 0 22 2 2 0 0 0 24 25 2 0 0 0 2 19 1 0 0 0 5 4 2 0 0 0 5 6 1 0 0 0 4 10 1 0 0 0 25 6 1 0 0 0 25 23 2 0 0 0 6 7 2 0 0 0 19 10 1 0 0 0 19 1 1 0 0 0 10 9 2 0 0 0 7 9 1 0 0 0 7 8 1 0 0 0 1 26 1 0 0 0 1 27 1 0 0 0 1 28 1 0 0 0 3 29 1 0 0 0 3 30 1 0 0 0 3 31 1 0 0 0 5 32 1 0 0 0 8 33 1 0 0 0 8 34 1 0 0 0 8 35 1 0 0 0 9 36 1 0 0 0 11 37 1 0 0 0 11 38 1 0 0 0 13 39 1 0 0 0 14 40 1 0 0 0 16 41 1 0 0 0 17 42 1 0 0 0 21 43 1 0 0 0 M END $$$$