HTS1710-04076235 63 67 0 0 0 0 0 0 0 0999 V2000 -0.1455 7.4550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3589 8.3366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6305 -8.1043 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6089 6.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5726 7.4550 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5577 0.7039 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1671 -9.5310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1677 -0.6665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1089 6.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3375 3.4444 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7489 -6.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2727 4.8148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3589 9.8366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0659 0.8606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4393 1.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2595 -9.9945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -1.8799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6595 -0.8232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3591 -5.5205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7429 -7.0476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8962 -3.2503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8291 3.2877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5443 2.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0146 -4.4638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1305 -8.1043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6246 -5.8341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4772 -4.3070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3805 -10.4127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5941 -9.5310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 10.5866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 10.5866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 12.0866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 12.0866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3589 12.8366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4616 5.5430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6895 5.2464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7701 4.4792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5163 0.7154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1078 0.2621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8561 1.4857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9368 2.2528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8693 -1.4483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7886 -2.2154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9558 -5.4577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -7.5957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4113 3.4329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7872 3.8862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9611 2.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0418 1.8955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0886 -7.5058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7127 -7.9591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2213 -5.8969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7213 -3.7589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7661 -10.8723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9948 -10.8723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1505 -9.3063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9121 -10.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4596 10.2866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1777 10.2866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1777 12.3866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4596 12.3866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3589 13.4366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2592 3.5072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 11 1 0 0 0 0 4 1 1 0 0 0 0 5 2 1 0 0 0 0 6 15 1 0 0 0 0 7 3 1 0 0 0 0 8 6 1 0 0 0 0 9 4 2 0 0 0 0 10 12 1 0 0 0 0 11 20 2 0 0 0 0 12 4 1 0 0 0 0 13 2 1 0 0 0 0 14 23 1 0 0 0 0 15 22 1 0 0 0 0 16 7 2 0 0 0 0 17 8 1 0 0 0 0 18 8 2 0 0 0 0 19 27 2 0 0 0 0 20 26 1 0 0 0 0 21 17 1 0 0 0 0 22 10 1 0 0 0 0 23 10 1 0 0 0 0 24 21 1 0 0 0 0 25 3 1 0 0 0 0 26 24 2 0 0 0 0 27 24 1 0 0 0 0 28 7 1 0 0 0 0 29 25 1 0 0 0 0 30 13 1 0 0 0 0 31 13 2 0 0 0 0 32 31 1 0 0 0 0 33 30 2 0 0 0 0 34 32 2 0 0 0 0 5 9 1 0 0 0 0 14 6 1 0 0 0 0 34 33 1 0 0 0 0 11 19 1 0 0 0 0 28 29 1 0 0 0 0 9 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 58 1 0 0 0 0 31 59 1 0 0 0 0 32 60 1 0 0 0 0 33 61 1 0 0 0 0 34 62 1 0 0 0 0 10 63 1 0 0 0 0 M END >HTS1710-04076235-01 > Namiki1710 > NS-019365397-0000 > C26H29N4O3S > 477.608 > 1 > 1 > 4 > 0 > 67.1800 > -10.1710 > -3.9107 > 5.365 > -7.078 > c1ccc(c5scc(n5)CN2CCN(C(COc3ccc(N4CCCC4=O)cc3)=O)CC2)cc1 > 30463916 $$$$