HMDB0247604 RDKit 3D 9-Nitrophenanthrene 26 28 0 0 0 0 0 0 0 0999 V2000 -2.8740 2.8329 -0.1692 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7707 2.7536 0.3538 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.3728 3.8611 1.1084 O 0 0 0 0 0 1 0 0 0 0 0 0 -0.8998 1.6606 0.1971 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4871 1.8871 0.1265 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3905 0.8671 -0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7476 1.1051 -0.0935 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6458 0.0894 -0.2447 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1968 -1.2050 -0.3304 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8241 -1.4684 -0.2615 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9226 -0.4414 -0.1089 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4459 -0.7218 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9218 -2.0063 -0.1159 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -2.3025 -0.0421 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -1.2559 0.1085 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6836 0.0445 0.1849 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3411 0.3575 0.1119 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8545 2.9017 0.1927 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0692 2.1139 -0.0236 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7213 0.2365 -0.3043 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8701 -2.0194 -0.4491 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -2.4789 -0.3306 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2814 -2.8600 -0.2347 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 -3.3398 -0.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1884 -1.4637 0.1688 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4171 0.8522 0.3239 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 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 15 16 1 0 16 17 2 0 17 4 1 0 11 6 1 0 17 12 1 0 5 18 1 0 7 19 1 0 8 20 1 0 9 21 1 0 10 22 1 0 13 23 1 0 14 24 1 0 15 25 1 0 16 26 1 0 M CHG 2 2 1 3 -1 M END