RDKit 3D 54 56 0 0 0 0 0 0 0 0999 V2000 -0.0723 0.4943 -3.3808 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5385 0.1588 -2.0656 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1202 -0.1111 -0.8775 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0359 -0.4442 0.3459 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3243 -0.2073 -0.7718 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9203 0.1040 -1.9882 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7475 -0.3363 -0.3886 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7285 -0.0711 -1.3574 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0925 -0.1691 -1.0634 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5107 -0.5392 0.2145 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5459 -0.8145 1.2027 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1798 -0.7105 0.8957 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0380 -1.1700 2.4347 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1136 -1.5439 3.4449 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8221 -0.6602 0.5986 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8228 -0.4268 -0.3828 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5494 -0.1263 -0.6275 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3931 0.1242 -1.4875 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9405 -0.4380 0.6629 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3308 -0.6494 1.0069 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1382 0.6265 0.9801 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6498 1.7372 1.6991 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3198 2.9543 1.6777 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4823 3.0493 0.9377 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9382 1.9784 0.2847 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.3432 0.7757 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0619 -0.1520 -0.4462 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5853 -1.2856 0.3213 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4662 -0.5132 -1.7403 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6994 0.6492 -4.1417 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7224 -0.3175 -3.7215 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6619 1.4135 -3.3075 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4341 0.2202 -2.3656 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7987 0.0520 -1.8571 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4463 -0.9213 1.6641 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4737 -0.7004 3.7242 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6851 -1.8344 4.3316 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5169 -2.4087 3.1361 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7891 0.6069 -0.7423 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7376 -1.1380 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7976 -0.5823 0.0895 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2224 -0.7712 1.2959 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3619 -1.0696 2.0182 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7142 -1.4079 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7218 1.6575 2.2672 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9315 3.8123 2.2208 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0660 3.9589 0.8551 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7963 2.0245 -0.2586 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8080 -2.0088 0.5838 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3440 -1.8101 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0729 -0.9427 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0952 0.3725 -2.2684 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6549 -1.2383 -1.6352 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2340 -0.9677 -2.3763 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 10 15 1 0 15 16 1 0 3 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 1 0 27 29 1 0 6 2 1 0 12 7 1 0 26 21 1 0 1 30 1 0 1 31 1 0 1 32 1 0 8 33 1 0 9 34 1 0 12 35 1 0 14 36 1 0 14 37 1 0 14 38 1 0 16 39 1 0 16 40 1 0 16 41 1 0 19 42 1 0 20 43 1 0 20 44 1 0 22 45 1 0 23 46 1 0 24 47 1 0 25 48 1 0 28 49 1 0 28 50 1 0 28 51 1 0 29 52 1 0 29 53 1 0 29 54 1 0 M CHG 1 25 1 M END