- printf("\nATOM 0: %f %f %f\n\n",itom->f.x,itom->f.y,itom->f.z);
+ //printf("\nATOM 0: %f %f %f\n\n",itom->f.x,itom->f.y,itom->f.z);
+ if(moldyn->time>DSTART&&moldyn->time<DEND) {
+ printf("force:\n");
+ printf(" x: %0.40f\n",moldyn->atom[5832].f.x);
+ printf(" y: %0.40f\n",moldyn->atom[5832].f.y);
+ printf(" z: %0.40f\n",moldyn->atom[5832].f.z);
+ }