REMARK Name = LIG001524 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 -4.012 -0.161 -0.010 0.00 0.00 -0.282 N ATOM 2 C LIG 1 -3.575 0.116 -1.297 0.00 0.00 +0.248 C ATOM 3 O LIG 1 -4.235 0.390 -2.280 0.00 0.00 -0.270 OA ATOM 4 C LIG 1 -2.110 0.038 -1.272 0.00 0.00 +0.042 A ATOM 5 C LIG 1 -1.711 -0.197 0.040 0.00 0.00 -0.016 A ATOM 6 C LIG 1 -0.366 -0.312 0.356 0.00 0.00 +0.029 A ATOM 7 C LIG 1 0.579 -0.191 -0.672 0.00 0.00 +0.034 A ATOM 8 C LIG 1 0.148 0.056 -1.996 0.00 0.00 +0.024 A ATOM 9 C LIG 1 -1.210 0.173 -2.308 0.00 0.00 +0.015 A ATOM 10 C LIG 1 -2.904 -0.262 0.931 0.00 0.00 +0.144 C ENDROOT BRANCH 1 17 ATOM 11 O LIG 1 -9.262 1.458 0.405 0.00 0.00 -0.275 OA ATOM 12 C LIG 1 -8.113 1.030 0.348 0.00 0.00 +0.219 C ATOM 13 N LIG 1 -7.038 1.864 0.529 0.00 0.00 -0.255 N ATOM 14 H LIG 1 -7.254 2.840 0.674 0.00 0.00 +0.158 HD ATOM 15 C LIG 1 -5.708 1.523 0.624 0.00 0.00 +0.240 C ATOM 16 O LIG 1 -4.872 2.370 0.933 0.00 0.00 -0.273 OA ATOM 17 C LIG 1 -5.383 0.031 0.452 0.00 0.00 +0.163 C ATOM 18 C LIG 1 -6.429 -0.648 -0.432 0.00 0.00 +0.041 C ATOM 19 C LIG 1 -7.809 -0.439 0.171 0.00 0.00 +0.098 C ENDBRANCH 1 17 BRANCH 7 20 ATOM 20 N LIG 1 1.971 -0.286 -0.465 0.00 0.00 -0.282 N ATOM 21 H LIG 1 2.549 -0.164 -1.287 0.00 0.00 +0.155 HD ATOM 22 C LIG 1 2.623 -0.590 0.712 0.00 0.00 +0.248 C ATOM 23 O LIG 1 2.117 -0.910 1.780 0.00 0.00 -0.270 OA BRANCH 22 24 ATOM 24 C LIG 1 4.105 -0.584 0.584 0.00 0.00 +0.052 C ATOM 25 C LIG 1 4.821 -1.699 1.285 0.00 0.00 +0.269 C ATOM 26 O LIG 1 6.171 -1.934 0.847 0.00 0.00 -0.487 OA ATOM 27 C LIG 1 6.851 -0.845 0.370 0.00 0.00 +0.128 A ATOM 28 C LIG 1 6.213 0.317 -0.080 0.00 0.00 +0.017 A ATOM 29 C LIG 1 6.983 1.373 -0.582 0.00 0.00 +0.011 A ATOM 30 C LIG 1 8.374 1.263 -0.634 0.00 0.00 +0.001 A ATOM 31 C LIG 1 9.002 0.097 -0.195 0.00 0.00 +0.004 A ATOM 32 C LIG 1 8.239 -0.959 0.302 0.00 0.00 +0.046 A ATOM 33 C LIG 1 4.758 0.399 -0.053 0.00 0.00 +0.023 C ENDBRANCH 22 24 ENDBRANCH 7 20 TORSDOF 3