D0G3AT OpenBabel05082020293D 67 68 0 0 0 0 0 0 0 0999 V2000 9.5076 12.8079 8.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8937 12.9505 7.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4617 11.3450 6.6827 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7957 10.0193 7.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5599 10.3324 8.3882 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5730 11.6416 8.2566 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0302 13.9376 5.9272 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.2453 8.6575 7.1964 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1695 7.7512 6.7245 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7137 6.4466 6.7331 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9580 5.4458 7.2439 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9891 5.3762 8.4578 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9884 4.7248 6.5166 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8652 4.5161 5.0153 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4227 4.4268 4.4863 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6248 5.4829 4.1652 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9358 6.3721 4.7308 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0177 5.5766 2.8915 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4086 4.2391 2.9503 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2150 3.0380 2.5078 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1076 3.8884 2.4128 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0572 6.5366 2.4617 C 0 0 1 0 0 0 0 0 0 0 0 0 12.0709 5.7161 1.7286 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5026 7.6154 1.5476 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5015 8.4694 1.0372 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0744 4.9700 0.2595 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3349 4.5795 -1.9116 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9338 4.1211 -2.3281 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7425 4.6606 -1.3521 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6908 4.0126 -0.5461 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5530 5.1526 -2.7987 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2811 8.5456 2.4804 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9307 9.2372 3.6883 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7089 9.7030 1.6576 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9346 7.6453 3.0755 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4896 8.7636 4.0769 Na 0 0 0 0 0 0 0 0 0 0 0 0 8.5562 12.9665 9.0105 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3049 11.0098 6.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0256 9.6692 8.9582 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8412 11.6158 7.9193 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5401 8.2951 8.1846 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0857 8.6545 6.4925 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7845 8.1685 5.7389 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2771 7.7543 7.3681 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2845 4.2502 7.1247 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4738 3.6366 4.8381 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9171 5.3799 4.7283 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8983 3.5815 4.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6986 4.9180 2.2343 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7363 5.2175 2.5103 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1733 2.1069 3.0652 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0103 3.1190 3.0613 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6154 3.0900 1.4833 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8453 2.9061 2.8589 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2288 3.7913 1.3126 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4012 4.6588 2.6808 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5528 7.0717 3.3254 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5185 5.0812 2.7046 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0378 6.4593 1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9868 7.1357 0.7048 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9521 8.9077 1.8056 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1732 4.6070 0.8366 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4704 3.5657 -3.0128 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2796 5.1702 -0.1655 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7193 6.0130 -1.4777 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5435 4.2258 -1.1767 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3031 3.0453 -0.2434 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 1 1 0 0 0 0 6 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 46 1 6 0 0 0 15 19 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 22 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 57 1 1 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 32 1 0 0 0 0 24 25 1 0 0 0 0 24 60 1 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 26 23 1 0 0 0 0 26 62 1 1 0 0 0 27 28 1 0 0 0 0 27 31 2 0 0 0 0 28 29 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 32 33 2 0 0 0 0 32 34 2 0 0 0 0 32 35 1 0 0 0 0 35 36 1 0 0 0 0 M END $$$$