@MOLECULE 3-{4-methyl-2-[(z)-(2-oxo-1,2-dihydro-3h-indol-3-ylidene)methyl]-1h-pyrrol-3-yl}propanoic acid 38 40 0 0 0 SMALL USER_CHARGES @ATOM 1 O -1.0404 -3.0650 -0.6024 O.2 1 UNL1111111 -0.5605 2 O 1.9361 3.8427 -1.2874 O.3 1 UNL1111111 -0.5681 3 O 0.7927 2.8808 0.3583 O.2 1 UNL1111111 -0.5338 4 N 1.5007 -2.3080 -0.0829 N.ar 1 UNL1111111 -0.2424 5 N -3.0365 -1.9640 -0.4970 N.am 1 UNL1111111 -0.5502 6 C 2.6355 -0.4194 0.4491 C.ar 1 UNL1111111 -0.0605 7 C 1.3410 -0.9657 0.2557 C.ar 1 UNL1111111 -0.0562 8 C 2.9419 0.9817 0.8128 C.3 1 UNL1111111 -0.2462 9 C 3.5699 -1.4527 0.2140 C.ar 1 UNL1111111 -0.0793 10 C -1.1536 -0.7042 0.0983 C.2 1 UNL1111111 -0.2111 11 C 0.0953 -0.2794 0.3667 C.2 1 UNL1111111 0.0063 12 C -2.3561 0.1238 0.2160 C.ar 1 UNL1111111 -0.0775 13 C 2.8368 -2.6108 -0.1150 C.ar 1 UNL1111111 -0.0902 14 C 2.8926 1.8946 -0.4247 C.3 1 UNL1111111 -0.3453 15 C -3.4845 -0.6726 -0.1479 C.ar 1 UNL1111111 0.1878 16 C -1.6361 -2.0352 -0.3625 C.2 1 UNL1111111 0.6184 17 C 5.0381 -1.3582 0.2969 C.3 1 UNL1111111 -0.4242 18 C -2.5374 1.4419 0.5822 C.ar 1 UNL1111111 -0.0910 19 C -4.7734 -0.1691 -0.1365 C.ar 1 UNL1111111 -0.2430 20 C -3.8408 1.9588 0.5959 C.ar 1 UNL1111111 -0.1980 21 C -4.9322 1.1694 0.2464 C.ar 1 UNL1111111 -0.0943 22 C 1.7608 2.8655 -0.3582 C.2 1 UNL1111111 0.6636 23 H 2.2400 1.3425 1.5990 H 1 UNL1111111 0.1715 24 H 3.9457 1.0453 1.2849 H 1 UNL1111111 0.1530 25 H 0.2052 0.7697 0.7197 H 1 UNL1111111 0.1958 26 H 0.7292 -2.9281 -0.2989 H 1 UNL1111111 0.3527 27 H 3.2022 -3.5901 -0.3552 H 1 UNL1111111 0.1686 28 H 3.8544 2.4360 -0.5537 H 1 UNL1111111 0.1798 29 H 2.7938 1.2854 -1.3554 H 1 UNL1111111 0.1982 30 H 5.3694 -1.1367 1.3234 H 1 UNL1111111 0.1536 31 H 5.5346 -2.2911 -0.0049 H 1 UNL1111111 0.1503 32 H 5.4308 -0.5608 -0.3518 H 1 UNL1111111 0.1528 33 H -3.6263 -2.7183 -0.7764 H 1 UNL1111111 0.3307 34 H -1.6890 2.0735 0.8516 H 1 UNL1111111 0.1707 35 H -5.6284 -0.7754 -0.4110 H 1 UNL1111111 0.1621 36 H -3.9956 2.9959 0.8848 H 1 UNL1111111 0.1519 37 H -5.9344 1.5961 0.2675 H 1 UNL1111111 0.1474 38 H 1.2046 4.5063 -1.3110 H 1 UNL1111111 0.3568 @BOND 1 29 14 1 2 38 2 1 3 2 22 1 4 33 5 1 5 1 16 2 6 28 14 1 7 5 16 am 8 5 15 1 9 14 22 1 10 14 8 1 11 35 19 1 12 16 10 1 13 22 3 2 14 27 13 1 15 32 17 1 16 26 4 1 17 15 19 ar 18 15 12 ar 19 19 21 ar 20 13 4 ar 21 13 9 ar 22 4 7 ar 23 31 17 1 24 10 12 1 25 10 11 2 26 9 17 1 27 9 6 ar 28 12 18 ar 29 21 37 1 30 21 20 ar 31 7 11 1 32 7 6 ar 33 17 30 1 34 11 25 1 35 6 8 1 36 18 20 ar 37 18 34 1 38 20 36 1 39 8 24 1 40 8 23 1