@MOLECULE ethyl 2-methylphenyl phthalate 37 38 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.5318 -0.5508 0.1504 O.3 1 UNL1111111111 -0.4041 2 O 1.0405 2.0096 0.4381 O.3 1 UNL1111111111 -0.4157 3 O -0.2340 -2.6485 -0.6527 O.2 1 UNL1111111111 -0.4491 4 O 0.7010 1.2626 -1.6661 O.2 1 UNL1111111111 -0.4719 5 C 1.6451 -1.2698 -0.0347 C.ar 1 UNL1111111111 -0.0997 6 C 2.1127 0.0400 -0.1508 C.ar 1 UNL1111111111 -0.0489 7 C -2.5886 0.0321 1.0827 C.ar 1 UNL1111111111 -0.0146 8 C -1.9038 -0.5712 0.0175 C.ar 1 UNL1111111111 0.2003 9 C 2.5229 -2.2985 0.3079 C.ar 1 UNL1111111111 -0.0896 10 C 0.2227 -1.6162 -0.2495 C.2 1 UNL1111111111 0.6026 11 C 3.4510 0.3328 0.0989 C.ar 1 UNL1111111111 -0.1304 12 C -3.9724 0.1511 0.9721 C.ar 1 UNL1111111111 -0.1580 13 C -2.5410 -1.0495 -1.1203 C.ar 1 UNL1111111111 -0.1904 14 C 3.8649 -2.0073 0.5471 C.ar 1 UNL1111111111 -0.1462 15 C 4.3261 -0.6956 0.4485 C.ar 1 UNL1111111111 -0.1126 16 C 1.2023 1.1333 -0.5812 C.2 1 UNL1111111111 0.6013 17 C -1.8431 0.5165 2.2737 C.3 1 UNL1111111111 -0.4395 18 C -4.6363 -0.3244 -0.1599 C.ar 1 UNL1111111111 -0.1675 19 C -3.9271 -0.9216 -1.1995 C.ar 1 UNL1111111111 -0.1315 20 C 0.1656 3.1184 0.2054 C.3 1 UNL1111111111 0.0097 21 C 0.8753 4.1735 -0.6251 C.3 1 UNL1111111111 -0.4815 22 H 2.1556 -3.3254 0.3833 H 1 UNL1111111111 0.1754 23 H 3.8100 1.3598 0.0241 H 1 UNL1111111111 0.1668 24 H -4.5402 0.6150 1.7759 H 1 UNL1111111111 0.1522 25 H -1.9733 -1.5134 -1.9264 H 1 UNL1111111111 0.1823 26 H 4.5538 -2.8081 0.8132 H 1 UNL1111111111 0.1575 27 H 5.3742 -0.4704 0.6442 H 1 UNL1111111111 0.1553 28 H -2.4618 1.1186 2.9500 H 1 UNL1111111111 0.1503 29 H -1.4411 -0.3274 2.8572 H 1 UNL1111111111 0.1645 30 H -0.9736 1.1311 1.9835 H 1 UNL1111111111 0.1709 31 H -5.7176 -0.2270 -0.2287 H 1 UNL1111111111 0.1500 32 H -4.4526 -1.2900 -2.0787 H 1 UNL1111111111 0.1540 33 H -0.7662 2.7606 -0.2709 H 1 UNL1111111111 0.1441 34 H -0.0398 3.4514 1.2400 H 1 UNL1111111111 0.1370 35 H 0.2801 5.0905 -0.6986 H 1 UNL1111111111 0.1526 36 H 1.8483 4.4370 -0.1944 H 1 UNL1111111111 0.1533 37 H 1.0549 3.8146 -1.6496 H 1 UNL1111111111 0.1712 @BOND 1 1 8 1 2 1 10 1 3 2 16 1 4 2 20 1 5 3 10 2 6 4 16 2 7 5 6 ar 8 5 9 ar 9 5 10 1 10 6 11 ar 11 6 16 1 12 7 8 ar 13 7 12 ar 14 7 17 1 15 8 13 ar 16 9 14 ar 17 9 22 1 18 11 15 ar 19 11 23 1 20 12 18 ar 21 12 24 1 22 13 19 ar 23 13 25 1 24 14 15 ar 25 14 26 1 26 15 27 1 27 17 28 1 28 17 29 1 29 17 30 1 30 18 19 ar 31 18 31 1 32 19 32 1 33 20 21 1 34 20 33 1 35 20 34 1 36 21 35 1 37 21 36 1 38 21 37 1