HMDB0015443 RDKit 3D Heptabarbital 36 37 0 0 0 0 0 0 0 0999 V2000 -1.6080 0.2098 2.0876 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8548 -0.5063 0.8194 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0953 -0.0422 -0.3913 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -0.1567 -0.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9026 -1.2882 -0.6004 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3746 -1.6193 -0.5002 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2249 -0.4223 -0.7476 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4872 0.2942 0.5715 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 0.4433 1.3599 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0724 0.9555 0.5163 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6181 -0.6892 -1.6142 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0073 -1.3533 -2.4705 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0449 -0.5589 -1.9093 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6836 0.6510 -1.5177 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9237 0.8485 -1.7365 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 1.6313 -0.8723 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5007 1.4234 -0.6215 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7363 2.3716 -0.6023 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6691 -0.1081 2.5733 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -0.1623 2.8143 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7877 1.3000 2.0769 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9608 -0.4714 0.6159 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6499 -1.5984 1.0263 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3095 -2.0947 -1.0144 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5171 -1.9956 0.5304 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -2.4432 -1.1876 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7604 0.3041 -1.4397 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2191 -0.7659 -1.1238 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1415 -0.3773 1.1652 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 1.2441 0.4405 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9112 -0.5236 1.8051 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3933 1.1773 2.1616 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3666 1.4660 1.1813 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5263 1.6420 -0.2367 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5596 -1.3282 -2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3469 2.5429 -0.5739 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 3 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 2 0 17 3 1 0 10 4 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 2 23 1 0 5 24 1 0 6 25 1 0 6 26 1 0 7 27 1 0 7 28 1 0 8 29 1 0 8 30 1 0 9 31 1 0 9 32 1 0 10 33 1 0 10 34 1 0 13 35 1 0 16 36 1 0 M END