HMDB0015583 RDKit 3D Bifonazole 42 45 0 0 0 0 0 0 0 0999 V2000 6.4430 -0.6042 0.4361 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5679 -1.6619 0.5702 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1998 -1.4687 0.5743 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 -0.2057 0.4436 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2296 0.0057 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -0.7683 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0045 -0.5097 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 0.5203 0.3639 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9744 0.8172 0.3192 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8431 -0.3476 0.4432 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2217 -0.7884 1.6931 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0506 -1.8938 1.8643 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -2.5694 0.7583 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1454 -2.1505 -0.4995 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3157 -1.0423 -0.6412 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2506 1.5462 -0.9359 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0056 2.6407 -1.0541 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0237 3.0117 -2.3641 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2723 2.1309 -3.0368 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7992 1.2337 -2.1602 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3354 1.2987 -0.3447 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6973 1.0374 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5528 0.8386 0.3108 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9292 0.6562 0.3054 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5194 -0.7176 0.4283 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0011 -2.6610 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5757 -2.3553 0.6848 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7547 -1.5768 1.7363 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7165 -1.1198 1.6644 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1718 1.5530 1.1542 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8915 -0.2952 2.5952 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3413 -2.2289 2.8728 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1524 -3.4271 0.9252 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5101 -2.6894 -1.3754 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0786 -0.7766 -1.6502 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5219 3.1566 -0.2546 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 3.8741 -2.8029 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1526 0.3939 -2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0566 2.1409 -0.9572 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3982 1.6563 -0.8615 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1672 1.8367 0.2071 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5835 1.5092 0.1981 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 9 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 8 21 1 0 21 22 2 0 4 23 1 0 23 24 2 0 24 1 1 0 22 5 1 0 15 10 1 0 20 16 1 0 1 25 1 0 2 26 1 0 3 27 1 0 6 28 1 0 7 29 1 0 9 30 1 0 11 31 1 0 12 32 1 0 13 33 1 0 14 34 1 0 15 35 1 0 17 36 1 0 18 37 1 0 20 38 1 0 21 39 1 0 22 40 1 0 23 41 1 0 24 42 1 0 M END